data_2rqq_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2rqq _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.421 ' CG1' HD23 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.445 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . 0.404 ' HD2' ' HE2' ' A' ' 551' ' ' HIS . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.417 ' HA ' HG21 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.417 HG21 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . 0.426 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.45 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . 0.404 ' HE2' ' HD2' ' A' ' 462' ' ' ARG . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.428 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.428 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.407 HD22 ' CG1' ' A' ' 539' ' ' VAL . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.407 ' HB ' ' HG ' ' A' ' 498' ' ' CYS . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.402 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.407 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.4 ' CG1' HD23 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.4 HD23 ' CG1' ' A' ' 539' ' ' VAL . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.48 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.48 ' HG ' HG13 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.441 ' CG1' ' HG ' ' A' ' 498' ' ' CYS . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.441 ' HG ' ' CG1' ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.428 ' CG1' HD22 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.476 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.458 ' HA ' HD21 ' A' ' 475' ' ' ASN . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . 0.458 HD21 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.43 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.441 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . 0.402 HG22 ' H ' ' A' ' 530' ' ' ASP . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . 0.402 ' H ' HG22 ' A' ' 527' ' ' ILE . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.441 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.404 ' HA ' HG23 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.417 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.417 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 119.692 -0.194 . . . . 0.0 111.491 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.455 HG12 ' HG ' ' A' ' 498' ' ' CYS . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.455 ' HG ' HG12 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.456 ' HG ' HG13 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.51 HG11 ' HG ' ' A' ' 498' ' ' CYS . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.51 ' HG ' HG11 ' A' ' 472' ' ' VAL . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . 0.45 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . 0.426 ' C ' ' H ' ' A' ' 520' ' ' ASP . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 518' ' ' LEU . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.4 ' HA ' HG21 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.4 HG21 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.409 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.402 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . 0.402 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . 0.402 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG1' HD22 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.442 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.606 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.606 ' HG ' HG13 ' A' ' 472' ' ' VAL . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . 0.453 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.423 ' CG1' HD23 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.509 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 119.2 -0.429 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . 0.406 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . 0.406 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.413 ' HA ' HG21 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.435 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.435 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . 0.414 ' HA ' HG23 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' VAL . . . . . 0.426 ' HB ' ' HG ' ' A' ' 498' ' ' CYS . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' MET . . . . . 0.421 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' CYS . . . . . 0.426 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . 0.403 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.403 HD22 ' CG1' ' A' ' 539' ' ' VAL . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.887 0 CA-C-O 119.66 -0.522 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -69.81 172.84 11.95 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 124.412 3.408 . . . . 0.0 113.08 176.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.83 164.05 6.79 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.574 1.549 . . . . 0.0 112.297 173.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -62.01 158.6 33.56 Favored Glycine 0 CA--C 1.541 1.698 0 O-C-N 121.039 -1.038 . . . . 0.0 113.917 171.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 9.3 t 48.55 47.41 20.46 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.192 1.397 . . . . 0.0 114.055 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 9.4 mtt -48.92 124.09 8.1 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 127.252 2.221 . . . . 0.0 113.319 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 13.0 t -160.1 150.31 18.42 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.014 0.926 . . . . 0.0 112.97 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 44.91 35.39 1.5 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.26 2.224 . . . . 0.0 116.054 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 90.5 m -88.28 141.43 30.84 Favored Pre-proline 0 CA--C 1.549 0.935 0 O-C-N 121.264 -0.898 . . . . 0.0 113.24 -178.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.45 6.37 3.62 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 125.048 3.832 . . . . 0.0 114.707 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -88.86 -19.99 25.18 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.684 1.193 . . . . 0.0 114.207 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -29.85 67.09 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 118.064 0.393 . . . . 0.0 111.725 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -77.62 -44.11 29.35 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.431 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 70.8 mt -59.0 -20.32 51.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.991 0.916 . . . . 0.0 113.402 -176.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -76.98 -46.18 24.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.913 0.485 . . . . 0.0 111.8 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.16 -29.5 28.58 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.742 0.817 . . . . 0.0 112.577 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.421 ' CG1' HD23 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.445 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 CA-C-O 118.469 -1.184 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.77 -177.43 2.2 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.135 3.223 . . . . 0.0 112.486 173.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 3.9 pp -55.24 -20.16 10.22 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 -178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 169.0 -138.54 5.16 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.436 1.493 . . . . 0.0 112.173 -173.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.1 m -56.37 -31.25 63.63 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 8.7 tpt 46.61 26.84 0.57 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 127.233 2.213 . . . . 0.0 115.413 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . 0.314 0.5 OUTLIER 57.12 11.76 1.12 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 -169.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -159.51 46.99 0.28 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 2.2 t -139.37 129.4 14.33 Favored Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.57 -10.46 26.77 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.675 2.917 . . . . 0.0 114.111 177.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -69.4 -20.43 63.8 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.525 1.511 . . . . 0.0 114.181 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.24 -34.47 70.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.991 0.516 . . . . 0.0 111.702 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -80.19 -42.22 23.77 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.014 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.57 -20.86 35.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -76.6 -45.15 31.42 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.1 0.56 . . . . 0.0 111.704 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -28.32 29.08 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.398 1.079 . . . . 0.0 112.963 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 69.8 m-80 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.49 132.63 41.63 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.002 3.134 . . . . 0.0 111.791 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 49.09 32.78 4.25 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.897 1.679 . . . . 0.0 112.755 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 76.69 -64.51 2.96 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.781 1.657 . . . . 0.0 111.663 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 54.4 m -146.51 95.78 2.66 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.236 1.814 . . . . 0.0 111.558 176.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -55.24 108.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.987 1.315 . . . . 0.0 111.871 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.4 m 34.14 70.99 0.11 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.381 2.272 . . . . 0.0 115.1 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 51.3 mtt85 54.89 44.34 28.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.127 1.371 . . . . 0.0 113.927 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.79 127.12 67.16 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.51 1.124 . . . . 0.0 113.509 -172.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.5 -12.61 35.28 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.208 2.606 . . . . 0.0 114.156 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.79 -24.12 65.28 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.197 1.362 . . . . 0.0 114.152 169.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.24 -35.35 71.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.129 0.877 . . . . 0.0 112.0 -177.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -79.73 -40.32 29.16 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 117.999 -1.001 . . . . 0.0 112.417 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.85 -24.57 16.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.172 0.897 . . . . 0.0 113.396 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.44 -45.13 40.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.401 0.68 . . . . 0.0 112.352 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp -83.23 -30.07 27.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 175.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . 0.404 ' HD2' ' HE2' ' A' ' 551' ' ' HIS . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.417 ' HA ' HG21 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.417 HG21 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . 0.426 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.45 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . 0.404 ' HE2' ' HD2' ' A' ' 462' ' ' ARG . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 CA-C-O 119.237 -0.757 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -83.79 27.14 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.895 3.73 . . . . 0.0 114.613 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 76.96 -41.51 0.39 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.123 2.169 . . . . 0.0 113.915 169.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 166.94 -62.36 0.21 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 126.112 1.815 . . . . 0.0 113.901 170.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 75.4 m -97.92 70.28 2.13 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.027 1.331 . . . . 0.0 113.238 -175.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.0 ttp -63.83 145.99 54.77 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.485 -0.76 . . . . 0.0 112.263 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.0 m 54.26 55.61 7.95 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.178 1.391 . . . . 0.0 114.502 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.2 13.13 2.01 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 175.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -152.36 146.68 18.61 Favored Pre-proline 0 N--CA 1.476 0.833 0 O-C-N 120.426 -1.422 . . . . 0.0 113.169 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.65 -28.46 44.5 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.237 2.625 . . . . 0.0 113.178 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.43 -31.33 72.01 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -32.26 71.23 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.71 0.686 . . . . 0.0 112.241 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -86.51 -49.54 7.51 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 117.636 -1.174 . . . . 0.0 113.49 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.1 pp -58.04 -23.22 53.46 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.163 1.347 . . . . 0.0 113.009 -175.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -78.07 -37.1 47.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.245 1.018 . . . . 0.0 112.985 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.87 -32.44 27.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.727 -0.608 . . . . 0.0 111.868 173.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.428 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.428 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.407 HD22 ' CG1' ' A' ' 539' ' ' VAL . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 CA-C-O 118.501 -1.166 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.94 -47.48 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.667 2.911 . . . . 0.0 114.34 -171.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pp 178.56 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 128.167 2.587 . . . . 0.0 112.706 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 158.98 -32.51 0.47 Allowed Glycine 0 CA--C 1.538 1.51 0 N-CA-C 116.083 1.193 . . . . 0.0 116.083 174.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 36.8 p -155.79 64.42 0.59 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.7 tpt -57.59 -28.41 63.59 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -175.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.4 m -76.89 -6.96 54.56 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.708 1.603 . . . . 0.0 114.909 -174.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -147.75 48.93 1.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.124 1.37 . . . . 0.0 113.688 -169.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 99.7 m -121.44 60.18 9.96 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 126.038 1.735 . . . . 0.0 112.244 174.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -62.41 -14.01 36.4 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.611 2.874 . . . . 0.0 114.404 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -66.16 -21.01 66.31 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 170.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -27.3 69.26 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.97 0.908 . . . . 0.0 112.199 176.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . 0.429 ' HB2' HE21 ' A' ' 461' ' ' GLN . 4.6 pt-20 -86.12 -41.84 14.39 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.176 -0.916 . . . . 0.0 112.796 174.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -54.08 -24.27 16.88 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -83.66 -38.43 21.53 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.01 0.924 . . . . 0.0 112.996 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.18 -34.11 26.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.766 0.826 . . . . 0.0 112.989 176.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 457' ' ' GLU . 35.6 mm-40 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.407 ' HB ' ' HG ' ' A' ' 498' ' ' CYS . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.402 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.407 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.4 ' CG1' HD23 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.4 HD23 ' CG1' ' A' ' 539' ' ' VAL . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 CA-C-O 119.701 -0.5 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.67 177.22 5.01 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 124.424 3.416 . . . . 0.0 113.239 176.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.06 3.89 0.53 Allowed 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 127.572 2.349 . . . . 0.0 115.992 -174.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 168.32 -161.95 35.7 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 127.12 2.295 . . . . 0.0 111.64 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.9 m -63.98 -11.75 31.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 171.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 13.2 mmt 48.6 65.69 1.28 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.639 1.976 . . . . 0.0 114.089 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 47.1 p -129.31 142.36 50.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.971 1.708 . . . . 0.0 111.628 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.69 57.9 0.42 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 127.362 2.265 . . . . 0.0 116.749 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 16.8 m -125.53 150.29 67.5 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.525 1.53 . . . . 0.0 113.377 -174.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -67.93 -16.14 44.93 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.251 3.3 . . . . 0.0 114.379 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -73.11 -20.37 60.95 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.84 1.2 . . . . 0.0 113.937 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -35.39 70.44 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.85 1.205 . . . . 0.0 112.496 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.0 -39.5 55.68 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.586 0.754 . . . . 0.0 112.248 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.8 mt -58.04 -17.44 17.72 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.788 1.235 . . . . 0.0 113.966 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.74 -48.7 14.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 171.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp -83.02 -28.26 29.77 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.48 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.48 ' HG ' HG13 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 CA-C-O 118.343 -1.254 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.95 -71.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.384 3.39 . . . . 0.0 115.085 -170.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 5.1 mp 34.49 51.88 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 128.451 2.7 . . . . 0.0 115.051 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 154.58 -18.56 0.59 Allowed Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.994 1.283 . . . . 0.0 115.471 -175.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 35.1 m -128.77 -0.46 5.4 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -169.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.21 72.55 8.25 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 120.868 -1.145 . . . . 0.0 113.188 -177.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 10.1 t -57.67 154.8 10.96 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.954 -1.091 . . . . 0.0 112.685 170.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 50.98 50.12 19.77 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.13 131.4 15.42 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.44 2.22 5.95 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.361 3.374 . . . . 0.0 114.737 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.92 -20.16 33.45 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.637 1.108 . . . . 0.0 113.271 169.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -34.46 67.99 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.094 0.558 . . . . 0.0 111.619 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -75.61 -42.97 50.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -59.07 -17.63 27.68 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.459 1.104 . . . . 0.0 113.226 179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.73 -44.23 21.16 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.436 0.694 . . . . 0.0 112.046 174.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.49 -29.62 27.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.343 1.057 . . . . 0.0 113.656 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.441 ' CG1' ' HG ' ' A' ' 498' ' ' CYS . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.441 ' HG ' ' CG1' ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.428 ' CG1' HD22 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.476 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 CA-C-O 119.058 -0.857 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -73.67 -1.24 10.46 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.96 3.106 . . . . 0.0 117.05 -171.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.299 1.0 OUTLIER 54.18 -174.57 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 126.377 1.871 . . . . 0.0 114.275 -169.4 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -54.7 118.2 9.31 Favored Glycine 0 CA--C 1.54 1.612 0 O-C-N 120.848 -1.158 . . . . 0.0 113.782 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 t 65.68 97.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.686 1.995 . . . . 0.0 114.482 -173.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.83 166.89 12.42 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.506 1.922 . . . . 0.0 113.175 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 42.3 m -143.43 119.69 10.85 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.873 -1.142 . . . . 0.0 112.481 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? 54.53 -165.96 0.09 Allowed 'General case' 0 CA--C 1.556 1.21 0 O-C-N 120.879 -1.138 . . . . 0.0 112.849 -172.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.8 t -56.71 130.99 78.13 Favored Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 120.636 -1.29 . . . . 0.0 112.141 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.48 -18.06 58.87 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 123.509 2.806 . . . . 0.0 115.03 -172.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.79 -32.52 69.39 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -34.52 77.02 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.479 0.581 . . . . 0.0 112.249 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -49.53 8.87 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-O 117.603 -1.189 . . . . 0.0 111.589 177.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.3 pp -58.03 -24.78 59.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.41 1.004 . . . . 0.0 112.634 -170.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -77.86 -37.14 48.92 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.228 1.411 . . . . 0.0 113.009 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.92 -34.23 26.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.639 0.776 . . . . 0.0 112.125 176.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.458 ' HA ' HD21 ' A' ' 475' ' ' ASN . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . 0.458 HD21 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.43 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.441 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . 0.402 HG22 ' H ' ' A' ' 530' ' ' ASP . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . 0.402 ' H ' HG22 ' A' ' 527' ' ' ILE . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.441 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.776 0 CA-C-O 118.836 -0.98 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.5 23.63 0.78 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.975 3.783 . . . . 0.0 115.578 -170.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.56 26.68 0.34 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 171.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.93 3.67 59.08 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.334 1.445 . . . . 0.0 116.451 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 64.2 p -104.5 -2.89 24.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.755 1.778 . . . . 0.0 115.617 -174.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -148.7 138.03 21.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.751 1.62 . . . . 0.0 111.761 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.5 m -151.49 151.56 31.79 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.94 1.696 . . . . 0.0 110.226 174.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.74 168.63 14.58 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.965 -1.084 . . . . 0.0 113.792 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.8 m 64.51 155.64 0.12 Allowed Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.075 2.55 . . . . 0.0 116.329 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.97 -19.39 39.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.327 2.685 . . . . 0.0 113.993 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -54.91 -35.79 64.53 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.46 -31.88 70.45 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -86.82 -49.52 7.37 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.02 -17.71 40.87 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.668 1.122 . . . . 0.0 113.662 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -83.53 -38.18 22.05 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.825 1.25 . . . . 0.0 112.866 174.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.38 -32.27 29.3 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.442 -0.786 . . . . 0.0 111.906 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.404 ' HA ' HG23 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.417 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.417 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 118.607 -1.107 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -81.38 34.68 0.56 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 125.076 3.851 . . . . 0.0 114.501 -172.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 71.72 -27.65 0.18 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 127.109 2.163 . . . . 0.0 116.052 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -179.16 49.06 0.09 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.132 1.825 . . . . 0.0 112.953 -171.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 86.4 p 49.21 31.56 3.7 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.9 2.08 . . . . 0.0 116.134 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.94 91.15 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.758 1.223 . . . . 0.0 114.068 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 12.0 m -148.72 147.57 29.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.527 1.931 . . . . 0.0 109.537 -175.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 38.6 44.63 0.8 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.689 1.995 . . . . 0.0 115.87 173.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 18.1 p -55.75 117.69 16.58 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.175 1.39 . . . . 0.0 114.455 -169.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -66.89 -23.65 47.23 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.87 2.38 . . . . 0.0 113.686 -176.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -59.15 -30.54 68.23 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.83 -31.33 63.17 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.64 0.655 . . . . 0.0 112.45 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -86.66 -49.23 7.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.012 -0.994 . . . . 0.0 113.669 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.94 -18.37 44.74 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.892 1.223 . . . . 0.0 113.537 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.3 ptm85 -79.95 -39.91 29.2 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.303 1.041 . . . . 0.0 112.586 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.67 -32.54 28.08 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.728 -0.608 . . . . 0.0 111.491 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 CA-C-O 118.581 -1.122 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.82 -178.81 4.04 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 124.242 3.294 . . . . 0.0 112.211 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -123.86 14.47 9.28 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -169.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 177.98 -60.51 0.09 OUTLIER Glycine 0 N--CA 1.474 1.232 0 O-C-N 121.389 -0.82 . . . . 0.0 114.088 169.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 66.1 m -149.52 111.88 4.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.185 1.394 . . . . 0.0 111.24 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 45.4 ttm -155.61 105.08 2.4 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.63 1.172 . . . . 0.0 111.345 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 8.8 t -63.31 133.28 53.88 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.312 -0.867 . . . . 0.0 112.487 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -152.76 -177.67 6.4 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.438 2.295 . . . . 0.0 110.83 172.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 92.6 m -45.27 157.31 0.35 Allowed Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 127.431 2.292 . . . . 0.0 115.618 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.34 -25.25 77.75 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.094 3.196 . . . . 0.0 114.779 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -59.4 -21.72 60.34 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 170.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -78.61 -40.39 34.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.008 0.822 . . . . 0.0 112.136 173.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -78.57 -39.86 36.42 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 117.946 -1.025 . . . . 0.0 112.562 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.2 pp -53.32 -22.11 6.72 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 38.3 mtp85 -74.37 -55.05 6.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.626 1.571 . . . . 0.0 110.543 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp -78.24 -29.21 48.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.261 0.624 . . . . 0.0 112.38 -176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.455 HG12 ' HG ' ' A' ' 498' ' ' CYS . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.455 ' HG ' HG12 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 119.533 -0.593 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.13 -66.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 124.401 3.4 . . . . 0.0 113.502 -171.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 20.2 mt 38.74 36.48 0.15 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 129.294 3.037 . . . . 0.0 116.906 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 173.99 -59.8 0.13 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.451 1.024 . . . . 0.0 114.209 174.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 74.0 m -84.21 -39.41 19.37 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.5 ptp 38.76 40.89 0.45 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 127.235 2.214 . . . . 0.0 116.476 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 61.8 m -154.97 149.73 26.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 125.749 1.62 . . . . 0.0 110.889 -177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 54.38 32.75 17.09 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.162 1.785 . . . . 0.0 115.164 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 93.5 m -130.77 58.26 37.55 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.315 1.446 . . . . 0.0 112.836 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.38 -11.59 26.42 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.57 2.846 . . . . 0.0 114.642 -177.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.07 -20.33 60.99 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 170.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -27.01 68.69 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.819 0.847 . . . . 0.0 111.937 177.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . 0.407 ' HB2' HE21 ' A' ' 461' ' ' GLN . 5.1 pt-20 -86.19 -42.34 13.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.98 175.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.99 -25.31 20.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.3 ptm85 -83.7 -38.14 21.83 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.137 0.975 . . . . 0.0 113.184 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.92 -32.29 27.32 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.359 0.664 . . . . 0.0 112.432 176.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . 0.407 HE21 ' HB2' ' A' ' 457' ' ' GLU . 31.6 mm-40 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 CA-C-O 119.113 -0.826 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.86 112.26 1.77 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 124.468 3.445 . . . . 0.0 112.489 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 64.1 mt 46.97 41.35 10.78 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.002 1.721 . . . . 0.0 114.45 174.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 86.55 30.92 20.3 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.199 0.904 . . . . 0.0 114.291 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 6.6 t 61.33 79.52 0.25 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.616 1.966 . . . . 0.0 113.363 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -44.15 153.27 0.15 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.762 2.025 . . . . 0.0 115.825 176.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m 55.55 59.84 3.66 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.247 1.819 . . . . 0.0 114.451 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 165.05 32.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.396 1.879 . . . . 0.0 112.66 171.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 75.9 m 8.92 81.98 0.05 OUTLIER Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 129.822 3.249 . . . . 0.0 116.474 169.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -61.66 -19.27 64.41 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 123.165 2.577 . . . . 0.0 114.981 -170.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.85 -21.95 66.69 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -31.14 70.88 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.058 0.943 . . . . 0.0 112.091 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -86.06 -41.32 14.9 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.208 177.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -52.76 -25.69 11.99 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -79.64 -46.18 17.68 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.027 0.931 . . . . 0.0 112.245 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.78 -29.72 29.42 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.566 0.746 . . . . 0.0 112.195 -177.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.456 ' HG ' HG13 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.867 0 CA-C-O 119.699 -0.5 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.74 171.23 16.88 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 124.072 3.181 . . . . 0.0 111.973 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -62.78 -17.5 61.19 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 176.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.34 -33.65 4.43 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 126.041 1.782 . . . . 0.0 113.734 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 88.2 p -89.74 32.53 0.88 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.226 1.81 . . . . 0.0 113.156 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.62 146.65 16.06 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.375 1.47 . . . . 0.0 112.231 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 68.3 p -60.03 170.79 1.12 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.812 1.245 . . . . 0.0 113.737 176.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -69.46 43.35 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 127.616 2.366 . . . . 0.0 115.996 -178.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 4.8 t -84.65 135.89 40.07 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.142 1.777 . . . . 0.0 113.103 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -70.06 -13.25 33.69 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.486 2.791 . . . . 0.0 114.696 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.47 -20.25 63.75 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.719 1.599 . . . . 0.0 114.241 171.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -30.59 65.89 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.605 0.762 . . . . 0.0 112.333 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -86.12 -43.85 12.72 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.367 -0.825 . . . . 0.0 112.755 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.5 mt -54.82 -25.17 26.56 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -81.33 -39.88 24.46 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.04 0.936 . . . . 0.0 112.8 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.12 -27.73 29.95 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.073 0.949 . . . . 0.0 112.297 176.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.51 HG11 ' HG ' ' A' ' 498' ' ' CYS . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.51 ' HG ' HG11 ' A' ' 472' ' ' VAL . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . 0.45 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . 0.426 ' C ' ' H ' ' A' ' 520' ' ' ASP . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 518' ' ' LEU . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 CA-C-O 118.672 -1.071 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.27 173.81 13.11 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.607 3.538 . . . . 0.0 112.514 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -56.71 -28.24 60.58 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 173.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 140.06 163.59 9.57 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 126.19 1.853 . . . . 0.0 113.193 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.8 t 59.58 -48.49 0.08 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 128.615 2.766 . . . . 0.0 117.066 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 11.8 ptt? 38.88 36.72 0.16 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.807 2.843 . . . . 0.0 117.049 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 23.2 m 60.96 113.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.521 1.928 . . . . 0.0 114.159 -169.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 3.8 mtp180 -78.28 62.71 3.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.513 1.525 . . . . 0.0 112.942 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 8.5 t -146.4 135.53 11.32 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.254 1.422 . . . . 0.0 111.543 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.94 -8.2 21.93 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.276 2.651 . . . . 0.0 114.413 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.26 -20.28 59.27 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.559 1.527 . . . . 0.0 114.607 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.66 -29.41 64.59 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.297 0.639 . . . . 0.0 111.9 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.95 -46.28 10.7 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.242 1.017 . . . . 0.0 113.029 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.4 mt -56.01 -24.97 42.36 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.427 1.012 . . . . 0.0 113.059 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 5.3 ptm85 -76.7 -44.8 32.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.445 0.698 . . . . 0.0 111.54 177.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 -30.19 31.63 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.258 -0.902 . . . . 0.0 112.215 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.4 ' HA ' HG21 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.4 HG21 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.409 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 CA-C-O 118.563 -1.132 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.36 -171.91 0.92 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.573 3.515 . . . . 0.0 112.373 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 14.3 mt -53.76 169.49 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.184 1.794 . . . . 0.0 113.129 169.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -50.99 138.12 26.94 Favored Glycine 0 CA--C 1.539 1.568 0 O-C-N 121.341 -0.85 . . . . 0.0 113.475 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.7 p 41.14 54.07 3.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.208 1.803 . . . . 0.0 115.661 -176.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 21.9 mtt -127.93 151.08 49.54 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.284 1.434 . . . . 0.0 113.243 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.0 t -144.16 21.38 1.74 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.034 1.734 . . . . 0.0 112.155 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.8 125.99 38.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.153 174.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 3.6 t -160.14 137.33 6.84 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.898 1.279 . . . . 0.0 110.821 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.48 -14.05 38.92 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.977 2.451 . . . . 0.0 114.378 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.05 -20.63 64.12 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 120.624 1.556 . . . . 0.0 114.66 172.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -29.68 69.56 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.253 0.479 . . . . 0.0 112.184 177.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -86.05 -42.16 14.19 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 117.88 -1.057 . . . . 0.0 112.606 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.7 mt -55.37 -24.03 27.46 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.487 1.04 . . . . 0.0 113.649 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -76.46 -45.3 31.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.242 0.617 . . . . 0.0 111.956 177.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.18 -28.74 29.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.387 1.075 . . . . 0.0 112.819 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.402 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . 0.402 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . 0.402 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG1' HD22 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.442 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.895 0 CA-C-O 119.158 -0.801 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -68.15 127.85 16.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.067 3.178 . . . . 0.0 111.958 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.254 0.5 OUTLIER 35.08 41.89 0.08 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 128.067 2.547 . . . . 0.0 116.336 178.815 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 64.74 18.88 64.55 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 124.876 1.227 . . . . 0.0 116.055 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.3 t 121.21 77.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 130.656 3.582 . . . . 0.0 111.079 176.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 14.1 ttt -48.25 133.15 15.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.227 1.411 . . . . 0.0 113.366 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.15 1.33 2.77 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.261 1.824 . . . . 0.0 115.266 -174.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -141.28 39.4 1.74 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.41 1.884 . . . . 0.0 112.497 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 41.1 t -138.54 130.41 15.72 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.041 1.336 . . . . 0.0 110.85 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.88 -20.86 64.59 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.443 2.762 . . . . 0.0 114.22 -174.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -33.36 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 170.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -33.94 76.97 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.297 0.639 . . . . 0.0 112.292 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -86.51 -50.55 6.77 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 117.808 -1.091 . . . . 0.0 113.476 177.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.6 pp -55.71 -28.97 58.56 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.538 1.063 . . . . 0.0 112.173 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.3 ptm85 -75.56 -35.72 60.57 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.403 1.081 . . . . 0.0 112.804 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.29 -34.14 28.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.177 0.591 . . . . 0.0 111.605 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.606 HG13 ' HG ' ' A' ' 498' ' ' CYS . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.606 ' HG ' HG13 ' A' ' 472' ' ' VAL . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . 0.453 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.423 ' CG1' HD23 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.509 ' CD2' ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 119.349 -0.695 . . . . 0.0 112.052 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -74.8 -175.95 2.58 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 124.552 3.501 . . . . 0.0 113.115 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.16 148.77 43.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.667 1.987 . . . . 0.0 111.08 177.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.85 23.35 63.3 Favored Glycine 0 CA--C 1.542 1.736 0 N-CA-C 116.844 1.497 . . . . 0.0 116.844 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.8 t 65.16 101.65 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.795 2.038 . . . . 0.0 113.97 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.97 19.89 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.429 1.492 . . . . 0.0 113.313 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.1 m 72.73 153.85 0.14 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 127.545 2.338 . . . . 0.0 112.095 -171.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 61.85 166.91 0.11 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.23 1.812 . . . . 0.0 113.064 -169.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.2 m 62.2 164.81 0.11 Allowed Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 126.563 1.945 . . . . 0.0 115.422 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.28 -23.45 75.3 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.801 2.334 . . . . 0.0 113.753 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.79 -29.52 70.2 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -74.91 -30.03 61.15 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.256 0.934 . . . . 0.0 112.958 174.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -86.65 -48.22 8.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.799 -1.096 . . . . 0.0 113.791 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -57.49 -23.11 48.09 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.747 1.158 . . . . 0.0 113.066 -176.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm85 -77.33 -43.26 33.64 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.787 0.835 . . . . 0.0 111.915 176.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 -33.07 29.3 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.647 0.779 . . . . 0.0 111.647 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . . . . . . . . . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . 0.406 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . 0.406 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 CA-C-O 119.242 -0.754 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.99 7.32 3.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 124.702 3.601 . . . . 0.0 116.554 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.287 1.3 pp 53.49 13.66 0.49 Allowed 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -176.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 174.61 -175.61 46.86 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.826 1.679 . . . . 0.0 112.971 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 33.3 p -57.88 143.88 41.01 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.947 -0.737 . . . . 0.0 112.541 170.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 6.5 ttm -127.28 109.54 11.91 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.525 1.53 . . . . 0.0 110.542 -177.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.2 t -66.31 168.0 9.48 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -108.34 6.67 26.65 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.24 1.816 . . . . 0.0 113.079 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 79.1 m -84.61 150.27 56.21 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.489 1.116 . . . . 0.0 113.607 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.24 -4.44 15.43 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 124.544 3.496 . . . . 0.0 114.595 176.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -80.3 -20.22 44.87 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 171.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.66 -26.39 67.05 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.38 0.672 . . . . 0.0 112.456 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -86.02 -43.55 13.04 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.401 1.081 . . . . 0.0 112.217 175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 52.8 mt -55.98 -23.38 32.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.951 0.9 . . . . 0.0 113.249 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -76.23 -46.65 27.2 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.859 0.464 . . . . 0.0 111.5 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.82 -31.13 28.28 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.951 0.9 . . . . 0.0 112.208 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.413 ' HA ' HG21 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.413 HG21 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.435 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.435 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.95 0 CA-C-O 119.751 -0.472 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.34 177.29 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.408 3.405 . . . . 0.0 112.656 175.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -62.24 -5.62 2.5 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -179.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -171.85 -56.88 0.04 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.118 -0.989 . . . . 0.0 114.47 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 67.6 m -147.87 -53.69 0.2 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.451 1.1 . . . . 0.0 112.508 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.44 166.16 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.366 2.266 . . . . 0.0 115.706 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 35.6 p -90.16 154.22 19.92 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.894 1.278 . . . . 0.0 111.774 170.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? 44.74 45.64 8.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.829 1.652 . . . . 0.0 115.038 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.9 m -121.91 67.58 23.51 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.773 1.629 . . . . 0.0 112.14 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -64.08 -7.91 14.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 123.667 2.911 . . . . 0.0 114.445 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.89 -21.17 61.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -25.93 68.53 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.03 0.932 . . . . 0.0 112.071 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' GLU . . . . . 0.464 ' HB2' HE21 ' A' ' 461' ' ' GLN . 4.1 pt-20 -85.89 -40.81 15.54 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 118.387 -0.816 . . . . 0.0 112.208 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -55.24 -21.89 15.91 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -83.77 -38.63 21.06 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.47 -34.39 25.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' GLN . . . . . 0.464 HE21 ' HB2' ' A' ' 457' ' ' GLU . 32.9 mm-40 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . 0.414 ' HA ' HG23 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' VAL . . . . . 0.426 ' HB ' ' HG ' ' A' ' 498' ' ' CYS . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' MET . . . . . 0.421 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' CYS . . . . . 0.426 ' HG ' ' HB ' ' A' ' 472' ' ' VAL . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . 0.403 ' CG1' HD22 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.403 HD22 ' CG1' ' A' ' 539' ' ' VAL . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.518 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.518 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.73 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 485' ' ' LEU . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 477' ' ' PHE . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.73 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.405 ' CD2' HD21 ' A' ' 466' ' ' LEU . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.426 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.588 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 475' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 478' ' ' VAL . 27.7 m120 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.763 HG13 ' HB3' ' A' ' 493' ' ' ARG . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.439 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 477' ' ' PHE . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.763 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.495 ' CE2' HD21 ' A' ' 535' ' ' LEU . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.495 HD21 ' CE2' ' A' ' 521' ' ' TRP . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.497 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.513 HD22 ' H ' ' A' ' 544' ' ' LEU . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 545' ' ' THR . . . . . 0.408 HG22 ' H ' ' A' ' 545' ' ' THR . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.483 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.483 ' N ' HD23 ' A' ' 463' ' ' LEU . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.546 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 493' ' ' ARG . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.72 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.431 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.529 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.568 ' N ' HD23 ' A' ' 463' ' ' LEU . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 513' ' ' LEU . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.698 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.698 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.481 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.774 HD11 HD21 ' A' ' 466' ' ' LEU . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.433 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.415 HD11 HD22 ' A' ' 466' ' ' LEU . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.54 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 493' ' ' ARG . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.657 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.497 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.526 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.526 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.609 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.609 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' VAL . . . . . 0.456 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' ALA . . . . . 0.501 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' ' 515' ' ' ALA . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' LEU . . . . . 0.456 HD11 ' HA ' ' A' ' 512' ' ' VAL . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.47 ' C ' HD23 ' A' ' 463' ' ' LEU . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.408 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.477 HH12 HG21 ' A' ' 500' ' ' THR . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 548' ' ' LEU . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.603 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.603 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.676 HG13 ' HB3' ' A' ' 493' ' ' ARG . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.676 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.56 ' SG ' HG11 ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.477 HG21 HH12 ' A' ' 465' ' ' ARG . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.42 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.54 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 548' ' ' LEU . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.672 ' HA ' HG22 ' A' ' 472' ' ' VAL . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.423 ' HA ' HD11 ' A' ' 485' ' ' LEU . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.689 ' HB3' HG13 ' A' ' 476' ' ' VAL . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.473 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.724 HD22 ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.54 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.54 ' N ' HD23 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.535 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.535 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.677 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.677 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.449 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 527' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 528' ' ' ARG . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' ARG . . . . . 0.4 ' N ' HG23 ' A' ' 527' ' ' ILE . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.581 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.581 HD21 ' CG1' ' A' ' 539' ' ' VAL . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 119.692 -0.194 . . . . 0.0 111.491 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.515 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.515 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.56 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.674 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.674 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 469' ' ' LEU . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.459 ' CE2' HD21 ' A' ' 535' ' ' LEU . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' LEU . . . . . 0.545 HD13 HG22 ' A' ' 533' ' ' VAL . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' VAL . . . . . 0.545 HG22 HD13 ' A' ' 524' ' ' LEU . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.459 HD21 ' CE2' ' A' ' 521' ' ' TRP . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.583 ' HA ' HG22 ' A' ' 472' ' ' VAL . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' ARG . . . . . 0.499 ' HA ' HD21 ' A' ' 541' ' ' LEU . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.617 HG13 ' HB3' ' A' ' 493' ' ' ARG . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.617 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.401 ' HG2' ' HG3' ' A' ' 507' ' ' MET . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.424 ' SG ' HG11 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' MET . . . . . 0.401 ' HG3' ' HG2' ' A' ' 494' ' ' MET . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 512' ' ' VAL . . . . . 0.422 ' HA ' HD11 ' A' ' 524' ' ' LEU . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 524' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 512' ' ' VAL . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 541' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 471' ' ' ARG . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.554 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.554 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 493' ' ' ARG . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.646 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.412 ' HE3' ' CG2' ' A' ' 495' ' ' VAL . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 495' ' ' VAL . . . . . 0.412 ' CG2' ' HE3' ' A' ' 494' ' ' MET . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' ALA . . . . . 0.403 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' LEU . . . . . 0.403 HD23 ' HB2' ' A' ' 515' ' ' ALA . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' LEU . . . . . 0.406 ' O ' HG22 ' A' ' 545' ' ' THR . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' THR . . . . . 0.452 ' HA ' HD22 ' A' ' 548' ' ' LEU . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 545' ' ' THR . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.501 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.539 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.668 HG13 ' HB3' ' A' ' 493' ' ' ARG . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.668 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.512 ' SG ' HG11 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 512' ' ' VAL . . . . . 0.509 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 524' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 512' ' ' VAL . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.416 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.796 ' HA ' HD23 ' A' ' 463' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 460' ' ' LEU . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.432 ' HB3' HD11 ' A' ' 548' ' ' LEU . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.556 ' HA ' HG22 ' A' ' 472' ' ' VAL . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 469' ' ' LEU . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 478' ' ' VAL . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.767 HG13 ' HB3' ' A' ' 493' ' ' ARG . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.767 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.535 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.535 HD21 ' CG1' ' A' ' 539' ' ' VAL . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.432 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.524 ' HB2' HD22 ' A' ' 463' ' ' LEU . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 555' ' ' GLU . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.525 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.525 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.744 HG13 ' HB3' ' A' ' 493' ' ' ARG . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.744 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.436 ' HB2' HD13 ' A' ' 463' ' ' LEU . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.483 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.483 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 475' ' ' ASN . . . . . 0.403 ' HA ' HG12 ' A' ' 478' ' ' VAL . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.706 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 475' ' ' ASN . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.706 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.46 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.446 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 549' ' ' ALA . . . . . 0.404 ' HA ' HG22 ' A' ' 552' ' ' VAL . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 549' ' ' ALA . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.528 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 493' ' ' ARG . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.67 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.402 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.402 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.405 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.565 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 119.2 -0.429 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.532 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.532 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.621 ' HB3' HG13 ' A' ' 476' ' ' VAL . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' LEU . . . . . 0.454 HD22 ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.454 ' H ' HD22 ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.505 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.664 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.46 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 517' ' ' LEU . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' LEU . . . . . 0.414 HD13 HD23 ' A' ' 513' ' ' LEU . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' VAL . . . . . 0.74 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' ARG . . . . . 0.74 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 494' ' ' MET . . . . . 0.459 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' ALA . . . . . 0.401 ' HB3' HD21 ' A' ' 524' ' ' LEU . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 518' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' TRP . . . . . 0.541 ' HB3' HD21 ' A' ' 518' ' ' LEU . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 522' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 533' ' ' VAL . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 524' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 515' ' ' ALA . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 527' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 530' ' ' ASP . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 530' ' ' ASP . . . . . 0.405 ' H ' HG22 ' A' ' 527' ' ' ILE . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' VAL . . . . . 0.602 HG22 HD11 ' A' ' 522' ' ' LEU . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 534' ' ' LYS . . . . . 0.478 ' O ' HD12 ' A' ' 522' ' ' LEU . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.429 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.887 0 CA-C-O 119.66 -0.522 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -69.81 172.84 11.95 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 124.412 3.408 . . . . 0.0 113.08 176.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.83 164.05 6.79 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.574 1.549 . . . . 0.0 112.297 173.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -62.01 158.6 33.56 Favored Glycine 0 CA--C 1.541 1.698 0 O-C-N 121.039 -1.038 . . . . 0.0 113.917 171.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 9.3 t 48.55 47.41 20.46 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.192 1.397 . . . . 0.0 114.055 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 9.4 mtt -48.92 124.09 8.1 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 127.252 2.221 . . . . 0.0 113.319 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 13.0 t -160.1 150.31 18.42 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.014 0.926 . . . . 0.0 112.97 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 44.91 35.39 1.5 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.26 2.224 . . . . 0.0 116.054 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 90.5 m -88.28 141.43 30.84 Favored Pre-proline 0 CA--C 1.549 0.935 0 O-C-N 121.264 -0.898 . . . . 0.0 113.24 -178.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.45 6.37 3.62 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 125.048 3.832 . . . . 0.0 114.707 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -88.86 -19.99 25.18 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.684 1.193 . . . . 0.0 114.207 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -29.85 67.09 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 118.064 0.393 . . . . 0.0 111.725 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -77.62 -44.11 29.35 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.431 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 70.8 mt -59.0 -20.32 51.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.991 0.916 . . . . 0.0 113.402 -176.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -76.98 -46.18 24.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.913 0.485 . . . . 0.0 111.8 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.16 -29.5 28.58 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.742 0.817 . . . . 0.0 112.577 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.518 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.518 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.73 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 485' ' ' LEU . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 477' ' ' PHE . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.73 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.405 ' CD2' HD21 ' A' ' 466' ' ' LEU . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.426 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 CA-C-O 118.469 -1.184 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.77 -177.43 2.2 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.135 3.223 . . . . 0.0 112.486 173.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 3.9 pp -55.24 -20.16 10.22 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 -178.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 169.0 -138.54 5.16 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.436 1.493 . . . . 0.0 112.173 -173.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.1 m -56.37 -31.25 63.63 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 8.7 tpt 46.61 26.84 0.57 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 127.233 2.213 . . . . 0.0 115.413 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . 0.314 0.5 OUTLIER 57.12 11.76 1.12 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 -169.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -159.51 46.99 0.28 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 2.2 t -139.37 129.4 14.33 Favored Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.57 -10.46 26.77 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.675 2.917 . . . . 0.0 114.111 177.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -69.4 -20.43 63.8 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.525 1.511 . . . . 0.0 114.181 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -34.47 70.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.991 0.516 . . . . 0.0 111.702 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -80.19 -42.22 23.77 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.014 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.57 -20.86 35.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -76.6 -45.15 31.42 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.1 0.56 . . . . 0.0 111.704 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -28.32 29.08 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.398 1.079 . . . . 0.0 112.963 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.588 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 475' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 478' ' ' VAL . 27.7 m120 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.763 HG13 ' HB3' ' A' ' 493' ' ' ARG . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.439 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 477' ' ' PHE . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.763 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.495 ' CE2' HD21 ' A' ' 535' ' ' LEU . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.495 HD21 ' CE2' ' A' ' 521' ' ' TRP . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.497 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.513 HD22 ' H ' ' A' ' 544' ' ' LEU . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 545' ' ' THR . . . . . 0.408 HG22 ' H ' ' A' ' 545' ' ' THR . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.49 132.63 41.63 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.002 3.134 . . . . 0.0 111.791 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 49.09 32.78 4.25 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.897 1.679 . . . . 0.0 112.755 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 76.69 -64.51 2.96 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.781 1.657 . . . . 0.0 111.663 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 54.4 m -146.51 95.78 2.66 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.236 1.814 . . . . 0.0 111.558 176.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -55.24 108.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.987 1.315 . . . . 0.0 111.871 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.4 m 34.14 70.99 0.11 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.381 2.272 . . . . 0.0 115.1 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 51.3 mtt85 54.89 44.34 28.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.127 1.371 . . . . 0.0 113.927 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.79 127.12 67.16 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.51 1.124 . . . . 0.0 113.509 -172.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.5 -12.61 35.28 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.208 2.606 . . . . 0.0 114.156 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.79 -24.12 65.28 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.197 1.362 . . . . 0.0 114.152 169.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -35.35 71.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.129 0.877 . . . . 0.0 112.0 -177.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -79.73 -40.32 29.16 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 117.999 -1.001 . . . . 0.0 112.417 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.85 -24.57 16.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.172 0.897 . . . . 0.0 113.396 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.44 -45.13 40.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.401 0.68 . . . . 0.0 112.352 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp -83.23 -30.07 27.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 175.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.483 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.483 ' N ' HD23 ' A' ' 463' ' ' LEU . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.546 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 493' ' ' ARG . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.72 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.431 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.529 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 CA-C-O 119.237 -0.757 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -83.79 27.14 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.895 3.73 . . . . 0.0 114.613 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 76.96 -41.51 0.39 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.123 2.169 . . . . 0.0 113.915 169.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 166.94 -62.36 0.21 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 126.112 1.815 . . . . 0.0 113.901 170.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 75.4 m -97.92 70.28 2.13 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.027 1.331 . . . . 0.0 113.238 -175.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.0 ttp -63.83 145.99 54.77 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.485 -0.76 . . . . 0.0 112.263 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.0 m 54.26 55.61 7.95 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.178 1.391 . . . . 0.0 114.502 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.2 13.13 2.01 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 175.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -152.36 146.68 18.61 Favored Pre-proline 0 N--CA 1.476 0.833 0 O-C-N 120.426 -1.422 . . . . 0.0 113.169 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.65 -28.46 44.5 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.237 2.625 . . . . 0.0 113.178 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.43 -31.33 72.01 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -32.26 71.23 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.71 0.686 . . . . 0.0 112.241 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -86.51 -49.54 7.51 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 117.636 -1.174 . . . . 0.0 113.49 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.1 pp -58.04 -23.22 53.46 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.163 1.347 . . . . 0.0 113.009 -175.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -78.07 -37.1 47.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.245 1.018 . . . . 0.0 112.985 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.87 -32.44 27.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.727 -0.608 . . . . 0.0 111.868 173.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.568 ' N ' HD23 ' A' ' 463' ' ' LEU . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 513' ' ' LEU . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.698 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.698 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.481 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.774 HD11 HD21 ' A' ' 466' ' ' LEU . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.433 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.415 HD11 HD22 ' A' ' 466' ' ' LEU . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 CA-C-O 118.501 -1.166 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.94 -47.48 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.667 2.911 . . . . 0.0 114.34 -171.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pp 178.56 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 128.167 2.587 . . . . 0.0 112.706 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 158.98 -32.51 0.47 Allowed Glycine 0 CA--C 1.538 1.51 0 N-CA-C 116.083 1.193 . . . . 0.0 116.083 174.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 36.8 p -155.79 64.42 0.59 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.7 tpt -57.59 -28.41 63.59 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -175.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.4 m -76.89 -6.96 54.56 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.708 1.603 . . . . 0.0 114.909 -174.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -147.75 48.93 1.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.124 1.37 . . . . 0.0 113.688 -169.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 99.7 m -121.44 60.18 9.96 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 126.038 1.735 . . . . 0.0 112.244 174.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -62.41 -14.01 36.4 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.611 2.874 . . . . 0.0 114.404 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -66.16 -21.01 66.31 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 170.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -27.3 69.26 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.97 0.908 . . . . 0.0 112.199 176.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -86.12 -41.84 14.39 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.176 -0.916 . . . . 0.0 112.796 174.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -54.08 -24.27 16.88 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -83.66 -38.43 21.53 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.01 0.924 . . . . 0.0 112.996 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.18 -34.11 26.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.766 0.826 . . . . 0.0 112.989 176.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.54 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 493' ' ' ARG . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.657 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.497 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 CA-C-O 119.701 -0.5 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.67 177.22 5.01 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 124.424 3.416 . . . . 0.0 113.239 176.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.06 3.89 0.53 Allowed 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 127.572 2.349 . . . . 0.0 115.992 -174.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 168.32 -161.95 35.7 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 127.12 2.295 . . . . 0.0 111.64 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.9 m -63.98 -11.75 31.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 171.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 13.2 mmt 48.6 65.69 1.28 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.639 1.976 . . . . 0.0 114.089 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 47.1 p -129.31 142.36 50.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.971 1.708 . . . . 0.0 111.628 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.69 57.9 0.42 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 127.362 2.265 . . . . 0.0 116.749 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 16.8 m -125.53 150.29 67.5 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.525 1.53 . . . . 0.0 113.377 -174.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -67.93 -16.14 44.93 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.251 3.3 . . . . 0.0 114.379 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -73.11 -20.37 60.95 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.84 1.2 . . . . 0.0 113.937 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -35.39 70.44 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.85 1.205 . . . . 0.0 112.496 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.0 -39.5 55.68 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.586 0.754 . . . . 0.0 112.248 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.8 mt -58.04 -17.44 17.72 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.788 1.235 . . . . 0.0 113.966 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.74 -48.7 14.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 171.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp -83.02 -28.26 29.77 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.526 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.526 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.609 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.609 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' VAL . . . . . 0.456 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' ALA . . . . . 0.501 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' ' 515' ' ' ALA . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' LEU . . . . . 0.456 HD11 ' HA ' ' A' ' 512' ' ' VAL . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 CA-C-O 118.343 -1.254 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.95 -71.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.384 3.39 . . . . 0.0 115.085 -170.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 5.1 mp 34.49 51.88 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 128.451 2.7 . . . . 0.0 115.051 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 154.58 -18.56 0.59 Allowed Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.994 1.283 . . . . 0.0 115.471 -175.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 35.1 m -128.77 -0.46 5.4 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -169.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.21 72.55 8.25 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 120.868 -1.145 . . . . 0.0 113.188 -177.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 10.1 t -57.67 154.8 10.96 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.954 -1.091 . . . . 0.0 112.685 170.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 50.98 50.12 19.77 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.13 131.4 15.42 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.44 2.22 5.95 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.361 3.374 . . . . 0.0 114.737 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.92 -20.16 33.45 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.637 1.108 . . . . 0.0 113.271 169.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -34.46 67.99 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.094 0.558 . . . . 0.0 111.619 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -75.61 -42.97 50.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -59.07 -17.63 27.68 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.459 1.104 . . . . 0.0 113.226 179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.73 -44.23 21.16 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.436 0.694 . . . . 0.0 112.046 174.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.49 -29.62 27.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.343 1.057 . . . . 0.0 113.656 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.47 ' C ' HD23 ' A' ' 463' ' ' LEU . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.408 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.477 HH12 HG21 ' A' ' 500' ' ' THR . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 548' ' ' LEU . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.603 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.603 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.676 HG13 ' HB3' ' A' ' 493' ' ' ARG . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.676 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.56 ' SG ' HG11 ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.477 HG21 HH12 ' A' ' 465' ' ' ARG . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.42 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.54 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 CA-C-O 119.058 -0.857 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -73.67 -1.24 10.46 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.96 3.106 . . . . 0.0 117.05 -171.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.299 1.0 OUTLIER 54.18 -174.57 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 126.377 1.871 . . . . 0.0 114.275 -169.4 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -54.7 118.2 9.31 Favored Glycine 0 CA--C 1.54 1.612 0 O-C-N 120.848 -1.158 . . . . 0.0 113.782 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 t 65.68 97.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.686 1.995 . . . . 0.0 114.482 -173.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.83 166.89 12.42 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.506 1.922 . . . . 0.0 113.175 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 42.3 m -143.43 119.69 10.85 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.873 -1.142 . . . . 0.0 112.481 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? 54.53 -165.96 0.09 Allowed 'General case' 0 CA--C 1.556 1.21 0 O-C-N 120.879 -1.138 . . . . 0.0 112.849 -172.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.8 t -56.71 130.99 78.13 Favored Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 120.636 -1.29 . . . . 0.0 112.141 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.48 -18.06 58.87 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 123.509 2.806 . . . . 0.0 115.03 -172.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.79 -32.52 69.39 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -34.52 77.02 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.479 0.581 . . . . 0.0 112.249 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -49.53 8.87 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-O 117.603 -1.189 . . . . 0.0 111.589 177.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.3 pp -58.03 -24.78 59.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.41 1.004 . . . . 0.0 112.634 -170.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -77.86 -37.14 48.92 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.228 1.411 . . . . 0.0 113.009 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.92 -34.23 26.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.639 0.776 . . . . 0.0 112.125 176.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 548' ' ' LEU . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.672 ' HA ' HG22 ' A' ' 472' ' ' VAL . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.423 ' HA ' HD11 ' A' ' 485' ' ' LEU . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.689 ' HB3' HG13 ' A' ' 476' ' ' VAL . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.473 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.724 HD22 ' H ' ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.776 0 CA-C-O 118.836 -0.98 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.5 23.63 0.78 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.975 3.783 . . . . 0.0 115.578 -170.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.56 26.68 0.34 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 171.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.93 3.67 59.08 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.334 1.445 . . . . 0.0 116.451 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 64.2 p -104.5 -2.89 24.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.755 1.778 . . . . 0.0 115.617 -174.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -148.7 138.03 21.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.751 1.62 . . . . 0.0 111.761 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.5 m -151.49 151.56 31.79 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.94 1.696 . . . . 0.0 110.226 174.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.74 168.63 14.58 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.965 -1.084 . . . . 0.0 113.792 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.8 m 64.51 155.64 0.12 Allowed Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.075 2.55 . . . . 0.0 116.329 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.97 -19.39 39.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.327 2.685 . . . . 0.0 113.993 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -54.91 -35.79 64.53 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.46 -31.88 70.45 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -86.82 -49.52 7.37 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.02 -17.71 40.87 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.668 1.122 . . . . 0.0 113.662 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -83.53 -38.18 22.05 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.825 1.25 . . . . 0.0 112.866 174.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.38 -32.27 29.3 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.442 -0.786 . . . . 0.0 111.906 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.54 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.54 ' N ' HD23 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.535 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.535 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.677 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.677 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.449 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 527' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 528' ' ' ARG . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' ARG . . . . . 0.4 ' N ' HG23 ' A' ' 527' ' ' ILE . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.581 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.581 HD21 ' CG1' ' A' ' 539' ' ' VAL . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 118.607 -1.107 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -81.38 34.68 0.56 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 125.076 3.851 . . . . 0.0 114.501 -172.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 71.72 -27.65 0.18 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 127.109 2.163 . . . . 0.0 116.052 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -179.16 49.06 0.09 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.132 1.825 . . . . 0.0 112.953 -171.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 86.4 p 49.21 31.56 3.7 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.9 2.08 . . . . 0.0 116.134 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.94 91.15 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.758 1.223 . . . . 0.0 114.068 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 12.0 m -148.72 147.57 29.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.527 1.931 . . . . 0.0 109.537 -175.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 38.6 44.63 0.8 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.689 1.995 . . . . 0.0 115.87 173.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 18.1 p -55.75 117.69 16.58 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.175 1.39 . . . . 0.0 114.455 -169.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -66.89 -23.65 47.23 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.87 2.38 . . . . 0.0 113.686 -176.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -59.15 -30.54 68.23 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -31.33 63.17 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.64 0.655 . . . . 0.0 112.45 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -86.66 -49.23 7.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.012 -0.994 . . . . 0.0 113.669 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.94 -18.37 44.74 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.892 1.223 . . . . 0.0 113.537 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.3 ptm85 -79.95 -39.91 29.2 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.303 1.041 . . . . 0.0 112.586 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.67 -32.54 28.08 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.728 -0.608 . . . . 0.0 111.491 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.515 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.515 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.56 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.674 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.674 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 469' ' ' LEU . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.459 ' CE2' HD21 ' A' ' 535' ' ' LEU . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' LEU . . . . . 0.545 HD13 HG22 ' A' ' 533' ' ' VAL . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' VAL . . . . . 0.545 HG22 HD13 ' A' ' 524' ' ' LEU . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.459 HD21 ' CE2' ' A' ' 521' ' ' TRP . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 CA-C-O 118.581 -1.122 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.82 -178.81 4.04 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 124.242 3.294 . . . . 0.0 112.211 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -123.86 14.47 9.28 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -169.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 177.98 -60.51 0.09 OUTLIER Glycine 0 N--CA 1.474 1.232 0 O-C-N 121.389 -0.82 . . . . 0.0 114.088 169.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 66.1 m -149.52 111.88 4.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.185 1.394 . . . . 0.0 111.24 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 45.4 ttm -155.61 105.08 2.4 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.63 1.172 . . . . 0.0 111.345 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 8.8 t -63.31 133.28 53.88 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.312 -0.867 . . . . 0.0 112.487 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -152.76 -177.67 6.4 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.438 2.295 . . . . 0.0 110.83 172.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 92.6 m -45.27 157.31 0.35 Allowed Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 127.431 2.292 . . . . 0.0 115.618 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.34 -25.25 77.75 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.094 3.196 . . . . 0.0 114.779 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -59.4 -21.72 60.34 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 170.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -78.61 -40.39 34.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.008 0.822 . . . . 0.0 112.136 173.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -78.57 -39.86 36.42 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 117.946 -1.025 . . . . 0.0 112.562 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.2 pp -53.32 -22.11 6.72 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 38.3 mtp85 -74.37 -55.05 6.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.626 1.571 . . . . 0.0 110.543 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp -78.24 -29.21 48.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.261 0.624 . . . . 0.0 112.38 -176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.583 ' HA ' HG22 ' A' ' 472' ' ' VAL . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' ARG . . . . . 0.499 ' HA ' HD21 ' A' ' 541' ' ' LEU . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.617 HG13 ' HB3' ' A' ' 493' ' ' ARG . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.617 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.401 ' HG2' ' HG3' ' A' ' 507' ' ' MET . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.424 ' SG ' HG11 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' MET . . . . . 0.401 ' HG3' ' HG2' ' A' ' 494' ' ' MET . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 512' ' ' VAL . . . . . 0.422 ' HA ' HD11 ' A' ' 524' ' ' LEU . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 524' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 512' ' ' VAL . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 471' ' ' ARG . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 119.533 -0.593 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.13 -66.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 124.401 3.4 . . . . 0.0 113.502 -171.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 20.2 mt 38.74 36.48 0.15 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 129.294 3.037 . . . . 0.0 116.906 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 173.99 -59.8 0.13 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.451 1.024 . . . . 0.0 114.209 174.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 74.0 m -84.21 -39.41 19.37 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.5 ptp 38.76 40.89 0.45 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 127.235 2.214 . . . . 0.0 116.476 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 61.8 m -154.97 149.73 26.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 125.749 1.62 . . . . 0.0 110.889 -177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 54.38 32.75 17.09 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.162 1.785 . . . . 0.0 115.164 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 93.5 m -130.77 58.26 37.55 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.315 1.446 . . . . 0.0 112.836 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.38 -11.59 26.42 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.57 2.846 . . . . 0.0 114.642 -177.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.07 -20.33 60.99 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 170.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -27.01 68.69 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.819 0.847 . . . . 0.0 111.937 177.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -86.19 -42.34 13.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.98 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.99 -25.31 20.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.3 ptm85 -83.7 -38.14 21.83 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.137 0.975 . . . . 0.0 113.184 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.92 -32.29 27.32 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.359 0.664 . . . . 0.0 112.432 176.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.554 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.554 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 493' ' ' ARG . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.646 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.412 ' HE3' ' CG2' ' A' ' 495' ' ' VAL . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 495' ' ' VAL . . . . . 0.412 ' CG2' ' HE3' ' A' ' 494' ' ' MET . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' ALA . . . . . 0.403 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' LEU . . . . . 0.403 HD23 ' HB2' ' A' ' 515' ' ' ALA . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' LEU . . . . . 0.406 ' O ' HG22 ' A' ' 545' ' ' THR . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' THR . . . . . 0.452 ' HA ' HD22 ' A' ' 548' ' ' LEU . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 545' ' ' THR . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 CA-C-O 119.113 -0.826 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.86 112.26 1.77 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 124.468 3.445 . . . . 0.0 112.489 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 64.1 mt 46.97 41.35 10.78 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.002 1.721 . . . . 0.0 114.45 174.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 86.55 30.92 20.3 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.199 0.904 . . . . 0.0 114.291 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 6.6 t 61.33 79.52 0.25 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.616 1.966 . . . . 0.0 113.363 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -44.15 153.27 0.15 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.762 2.025 . . . . 0.0 115.825 176.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m 55.55 59.84 3.66 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.247 1.819 . . . . 0.0 114.451 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 165.05 32.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.396 1.879 . . . . 0.0 112.66 171.043 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 75.9 m 8.92 81.98 0.05 OUTLIER Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 129.822 3.249 . . . . 0.0 116.474 169.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -61.66 -19.27 64.41 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 123.165 2.577 . . . . 0.0 114.981 -170.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.85 -21.95 66.69 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -31.14 70.88 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.058 0.943 . . . . 0.0 112.091 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -86.06 -41.32 14.9 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.208 177.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -52.76 -25.69 11.99 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -79.64 -46.18 17.68 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.027 0.931 . . . . 0.0 112.245 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.78 -29.72 29.42 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.566 0.746 . . . . 0.0 112.195 -177.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.501 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.539 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.668 HG13 ' HB3' ' A' ' 493' ' ' ARG . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.668 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.512 ' SG ' HG11 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' VAL . . . . . 0.509 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 524' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 512' ' ' VAL . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.416 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.867 0 CA-C-O 119.699 -0.5 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.74 171.23 16.88 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 124.072 3.181 . . . . 0.0 111.973 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -62.78 -17.5 61.19 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 176.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.34 -33.65 4.43 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 126.041 1.782 . . . . 0.0 113.734 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 88.2 p -89.74 32.53 0.88 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.226 1.81 . . . . 0.0 113.156 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.62 146.65 16.06 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.375 1.47 . . . . 0.0 112.231 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 68.3 p -60.03 170.79 1.12 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.812 1.245 . . . . 0.0 113.737 176.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -69.46 43.35 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 127.616 2.366 . . . . 0.0 115.996 -178.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 4.8 t -84.65 135.89 40.07 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.142 1.777 . . . . 0.0 113.103 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -70.06 -13.25 33.69 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.486 2.791 . . . . 0.0 114.696 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.47 -20.25 63.75 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.719 1.599 . . . . 0.0 114.241 171.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -30.59 65.89 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.605 0.762 . . . . 0.0 112.333 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -86.12 -43.85 12.72 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.367 -0.825 . . . . 0.0 112.755 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.5 mt -54.82 -25.17 26.56 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -81.33 -39.88 24.46 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.04 0.936 . . . . 0.0 112.8 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.796 ' HA ' HD23 ' A' ' 463' ' ' LEU . 0.7 OUTLIER -83.12 -27.73 29.95 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.073 0.949 . . . . 0.0 112.297 176.403 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 460' ' ' LEU . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.432 ' HB3' HD11 ' A' ' 548' ' ' LEU . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.556 ' HA ' HG22 ' A' ' 472' ' ' VAL . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 469' ' ' LEU . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 478' ' ' VAL . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.767 HG13 ' HB3' ' A' ' 493' ' ' ARG . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.767 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.535 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.535 HD21 ' CG1' ' A' ' 539' ' ' VAL . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.432 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.524 ' HB2' HD22 ' A' ' 463' ' ' LEU . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 CA-C-O 118.672 -1.071 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.27 173.81 13.11 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.607 3.538 . . . . 0.0 112.514 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -56.71 -28.24 60.58 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 173.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 140.06 163.59 9.57 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 126.19 1.853 . . . . 0.0 113.193 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.8 t 59.58 -48.49 0.08 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 128.615 2.766 . . . . 0.0 117.066 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 11.8 ptt? 38.88 36.72 0.16 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.807 2.843 . . . . 0.0 117.049 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 23.2 m 60.96 113.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.521 1.928 . . . . 0.0 114.159 -169.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 3.8 mtp180 -78.28 62.71 3.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.513 1.525 . . . . 0.0 112.942 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 8.5 t -146.4 135.53 11.32 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.254 1.422 . . . . 0.0 111.543 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.94 -8.2 21.93 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.276 2.651 . . . . 0.0 114.413 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.26 -20.28 59.27 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.559 1.527 . . . . 0.0 114.607 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.66 -29.41 64.59 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.297 0.639 . . . . 0.0 111.9 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.95 -46.28 10.7 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.242 1.017 . . . . 0.0 113.029 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.4 mt -56.01 -24.97 42.36 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.427 1.012 . . . . 0.0 113.059 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 5.3 ptm85 -76.7 -44.8 32.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.445 0.698 . . . . 0.0 111.54 177.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 -30.19 31.63 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.258 -0.902 . . . . 0.0 112.215 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 555' ' ' GLU . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.525 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.525 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.744 HG13 ' HB3' ' A' ' 493' ' ' ARG . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.744 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.436 ' HB2' HD13 ' A' ' 463' ' ' LEU . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 CA-C-O 118.563 -1.132 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.36 -171.91 0.92 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.573 3.515 . . . . 0.0 112.373 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 14.3 mt -53.76 169.49 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.184 1.794 . . . . 0.0 113.129 169.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -50.99 138.12 26.94 Favored Glycine 0 CA--C 1.539 1.568 0 O-C-N 121.341 -0.85 . . . . 0.0 113.475 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.7 p 41.14 54.07 3.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.208 1.803 . . . . 0.0 115.661 -176.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 21.9 mtt -127.93 151.08 49.54 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.284 1.434 . . . . 0.0 113.243 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.0 t -144.16 21.38 1.74 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.034 1.734 . . . . 0.0 112.155 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.8 125.99 38.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.153 174.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 3.6 t -160.14 137.33 6.84 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.898 1.279 . . . . 0.0 110.821 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.48 -14.05 38.92 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.977 2.451 . . . . 0.0 114.378 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.05 -20.63 64.12 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 120.624 1.556 . . . . 0.0 114.66 172.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -29.68 69.56 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.253 0.479 . . . . 0.0 112.184 177.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -86.05 -42.16 14.19 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 117.88 -1.057 . . . . 0.0 112.606 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.7 mt -55.37 -24.03 27.46 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.487 1.04 . . . . 0.0 113.649 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -76.46 -45.3 31.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.242 0.617 . . . . 0.0 111.956 177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.18 -28.74 29.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.387 1.075 . . . . 0.0 112.819 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.483 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.483 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 475' ' ' ASN . . . . . 0.403 ' HA ' HG12 ' A' ' 478' ' ' VAL . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.706 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 475' ' ' ASN . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.706 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.46 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.446 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 549' ' ' ALA . . . . . 0.404 ' HA ' HG22 ' A' ' 552' ' ' VAL . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 549' ' ' ALA . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.895 0 CA-C-O 119.158 -0.801 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -68.15 127.85 16.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.067 3.178 . . . . 0.0 111.958 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.254 0.5 OUTLIER 35.08 41.89 0.08 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 128.067 2.547 . . . . 0.0 116.336 178.815 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 64.74 18.88 64.55 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 124.876 1.227 . . . . 0.0 116.055 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.3 t 121.21 77.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 130.656 3.582 . . . . 0.0 111.079 176.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 14.1 ttt -48.25 133.15 15.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.227 1.411 . . . . 0.0 113.366 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.15 1.33 2.77 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.261 1.824 . . . . 0.0 115.266 -174.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -141.28 39.4 1.74 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.41 1.884 . . . . 0.0 112.497 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 41.1 t -138.54 130.41 15.72 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.041 1.336 . . . . 0.0 110.85 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.88 -20.86 64.59 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.443 2.762 . . . . 0.0 114.22 -174.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -33.36 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 170.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -33.94 76.97 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.297 0.639 . . . . 0.0 112.292 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -86.51 -50.55 6.77 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 117.808 -1.091 . . . . 0.0 113.476 177.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.6 pp -55.71 -28.97 58.56 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.538 1.063 . . . . 0.0 112.173 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.3 ptm85 -75.56 -35.72 60.57 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.403 1.081 . . . . 0.0 112.804 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.29 -34.14 28.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.177 0.591 . . . . 0.0 111.605 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.528 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 493' ' ' ARG . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.67 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.402 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.402 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.405 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.565 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 119.349 -0.695 . . . . 0.0 112.052 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -74.8 -175.95 2.58 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 124.552 3.501 . . . . 0.0 113.115 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.16 148.77 43.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.667 1.987 . . . . 0.0 111.08 177.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.85 23.35 63.3 Favored Glycine 0 CA--C 1.542 1.736 0 N-CA-C 116.844 1.497 . . . . 0.0 116.844 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.8 t 65.16 101.65 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.795 2.038 . . . . 0.0 113.97 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.97 19.89 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.429 1.492 . . . . 0.0 113.313 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.1 m 72.73 153.85 0.14 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 127.545 2.338 . . . . 0.0 112.095 -171.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 61.85 166.91 0.11 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.23 1.812 . . . . 0.0 113.064 -169.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.2 m 62.2 164.81 0.11 Allowed Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 126.563 1.945 . . . . 0.0 115.422 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.28 -23.45 75.3 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.801 2.334 . . . . 0.0 113.753 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.79 -29.52 70.2 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.91 -30.03 61.15 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.256 0.934 . . . . 0.0 112.958 174.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -86.65 -48.22 8.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.799 -1.096 . . . . 0.0 113.791 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -57.49 -23.11 48.09 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.747 1.158 . . . . 0.0 113.066 -176.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm85 -77.33 -43.26 33.64 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.787 0.835 . . . . 0.0 111.915 176.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 -33.07 29.3 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.647 0.779 . . . . 0.0 111.647 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.532 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.532 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.621 ' HB3' HG13 ' A' ' 476' ' ' VAL . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' LEU . . . . . 0.454 HD22 ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.454 ' H ' HD22 ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 CA-C-O 119.242 -0.754 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.99 7.32 3.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 124.702 3.601 . . . . 0.0 116.554 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.287 1.3 pp 53.49 13.66 0.49 Allowed 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -176.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 174.61 -175.61 46.86 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.826 1.679 . . . . 0.0 112.971 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 33.3 p -57.88 143.88 41.01 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.947 -0.737 . . . . 0.0 112.541 170.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 6.5 ttm -127.28 109.54 11.91 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.525 1.53 . . . . 0.0 110.542 -177.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.2 t -66.31 168.0 9.48 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -108.34 6.67 26.65 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.24 1.816 . . . . 0.0 113.079 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 79.1 m -84.61 150.27 56.21 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.489 1.116 . . . . 0.0 113.607 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.24 -4.44 15.43 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 124.544 3.496 . . . . 0.0 114.595 176.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -80.3 -20.22 44.87 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 171.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.66 -26.39 67.05 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.38 0.672 . . . . 0.0 112.456 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -86.02 -43.55 13.04 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.401 1.081 . . . . 0.0 112.217 175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 52.8 mt -55.98 -23.38 32.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.951 0.9 . . . . 0.0 113.249 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -76.23 -46.65 27.2 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.859 0.464 . . . . 0.0 111.5 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.82 -31.13 28.28 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.951 0.9 . . . . 0.0 112.208 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.505 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.664 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.46 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 517' ' ' LEU . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' LEU . . . . . 0.414 HD13 HD23 ' A' ' 513' ' ' LEU . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.95 0 CA-C-O 119.751 -0.472 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.34 177.29 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.408 3.405 . . . . 0.0 112.656 175.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -62.24 -5.62 2.5 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -179.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -171.85 -56.88 0.04 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.118 -0.989 . . . . 0.0 114.47 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 67.6 m -147.87 -53.69 0.2 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.451 1.1 . . . . 0.0 112.508 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.44 166.16 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.366 2.266 . . . . 0.0 115.706 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 35.6 p -90.16 154.22 19.92 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.894 1.278 . . . . 0.0 111.774 170.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? 44.74 45.64 8.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.829 1.652 . . . . 0.0 115.038 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.9 m -121.91 67.58 23.51 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.773 1.629 . . . . 0.0 112.14 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -64.08 -7.91 14.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 123.667 2.911 . . . . 0.0 114.445 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.89 -21.17 61.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -25.93 68.53 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.03 0.932 . . . . 0.0 112.071 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -85.89 -40.81 15.54 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 118.387 -0.816 . . . . 0.0 112.208 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -55.24 -21.89 15.91 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -83.77 -38.63 21.06 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.47 -34.39 25.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' VAL . . . . . 0.74 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' ARG . . . . . 0.74 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 494' ' ' MET . . . . . 0.459 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' ALA . . . . . 0.401 ' HB3' HD21 ' A' ' 524' ' ' LEU . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 518' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' TRP . . . . . 0.541 ' HB3' HD21 ' A' ' 518' ' ' LEU . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 522' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 533' ' ' VAL . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 524' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 515' ' ' ALA . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 527' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 530' ' ' ASP . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 530' ' ' ASP . . . . . 0.405 ' H ' HG22 ' A' ' 527' ' ' ILE . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' VAL . . . . . 0.602 HG22 HD11 ' A' ' 522' ' ' LEU . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 534' ' ' LYS . . . . . 0.478 ' O ' HD12 ' A' ' 522' ' ' LEU . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.429 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.518 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.518 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.73 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 485' ' ' LEU . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 477' ' ' PHE . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.73 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.405 ' CD2' HD21 ' A' ' 466' ' ' LEU . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.426 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.542 0.658 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.588 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 478' ' ' VAL . 69.8 m-80 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.763 HG13 ' HB3' ' A' ' 493' ' ' ARG . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.439 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 477' ' ' PHE . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.763 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.495 ' CE2' HD21 ' A' ' 535' ' ' LEU . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.495 HD21 ' CE2' ' A' ' 521' ' ' TRP . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.497 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.513 ' H ' HD22 ' A' ' 544' ' ' LEU . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . 0.408 HG22 ' H ' ' A' ' 545' ' ' THR . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.483 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.483 ' N ' HD23 ' A' ' 463' ' ' LEU . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.546 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 493' ' ' ARG . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.72 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.431 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.529 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.568 ' N ' HD23 ' A' ' 463' ' ' LEU . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 513' ' ' LEU . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.698 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.698 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.481 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.774 HD11 HD21 ' A' ' 466' ' ' LEU . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.433 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.415 HD11 HD22 ' A' ' 466' ' ' LEU . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.81 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.54 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 493' ' ' ARG . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.657 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.497 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.526 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.526 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.609 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.609 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . 0.456 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . 0.501 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' ' 515' ' ' ALA . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . 0.456 HD11 ' HA ' ' A' ' 512' ' ' VAL . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.47 HD23 ' C ' ' A' ' 463' ' ' LEU . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.408 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.477 HH12 HG21 ' A' ' 500' ' ' THR . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 548' ' ' LEU . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.603 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.603 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.676 HG13 ' HB3' ' A' ' 493' ' ' ARG . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.676 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.56 ' SG ' HG11 ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.477 HG21 HH12 ' A' ' 465' ' ' ARG . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.42 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.54 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.709 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 548' ' ' LEU . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.672 ' HA ' HG22 ' A' ' 472' ' ' VAL . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.423 ' HA ' HD11 ' A' ' 485' ' ' LEU . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.689 ' HB3' HG13 ' A' ' 476' ' ' VAL . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.473 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.724 ' H ' HD22 ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.54 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.54 ' N ' HD23 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.535 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.535 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.677 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.677 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.449 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 528' ' ' ARG . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . 0.4 ' N ' HG23 ' A' ' 527' ' ' ILE . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.581 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.581 HD21 ' CG1' ' A' ' 539' ' ' VAL . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.543 0.708 0 CA-C-O 119.692 -0.194 . . . . 0.0 111.491 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.515 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.515 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.56 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.674 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.674 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 469' ' ' LEU . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.459 ' CE2' HD21 ' A' ' 535' ' ' LEU . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . 0.545 HD13 HG22 ' A' ' 533' ' ' VAL . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . 0.545 HG22 HD13 ' A' ' 524' ' ' LEU . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.459 HD21 ' CE2' ' A' ' 521' ' ' TRP . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.583 ' HA ' HG22 ' A' ' 472' ' ' VAL . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . 0.499 ' HA ' HD21 ' A' ' 541' ' ' LEU . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.617 HG13 ' HB3' ' A' ' 493' ' ' ARG . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.617 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.401 ' HG2' ' HG3' ' A' ' 507' ' ' MET . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.424 ' SG ' HG11 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . 0.401 ' HG3' ' HG2' ' A' ' 494' ' ' MET . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . 0.422 ' HA ' HD11 ' A' ' 524' ' ' LEU . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 512' ' ' VAL . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 471' ' ' ARG . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.554 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.554 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 493' ' ' ARG . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.646 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.412 ' HE3' ' CG2' ' A' ' 495' ' ' VAL . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . 0.412 ' CG2' ' HE3' ' A' ' 494' ' ' MET . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . 0.403 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . 0.403 HD23 ' HB2' ' A' ' 515' ' ' ALA . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . 0.406 ' O ' HG22 ' A' ' 545' ' ' THR . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . 0.452 ' HA ' HD22 ' A' ' 548' ' ' LEU . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 545' ' ' THR . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.501 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.539 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.668 HG13 ' HB3' ' A' ' 493' ' ' ARG . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.668 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.512 ' SG ' HG11 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . 0.509 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 512' ' ' VAL . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.416 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.796 ' HA ' HD23 ' A' ' 463' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 460' ' ' LEU . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.432 ' HB3' HD11 ' A' ' 548' ' ' LEU . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.556 ' HA ' HG22 ' A' ' 472' ' ' VAL . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 469' ' ' LEU . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 478' ' ' VAL . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.767 HG13 ' HB3' ' A' ' 493' ' ' ARG . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.767 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.535 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.535 HD21 ' CG1' ' A' ' 539' ' ' VAL . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.432 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.524 ' HB2' HD22 ' A' ' 463' ' ' LEU . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.731 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 555' ' ' GLU . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.525 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.525 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.744 HG13 ' HB3' ' A' ' 493' ' ' ARG . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.744 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.436 ' HB2' HD13 ' A' ' 463' ' ' LEU . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.483 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.483 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . 0.403 ' HA ' HG12 ' A' ' 478' ' ' VAL . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.706 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 475' ' ' ASN . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.706 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.46 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.446 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . 0.404 ' HA ' HG22 ' A' ' 552' ' ' VAL . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 549' ' ' ALA . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.528 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 493' ' ' ARG . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.67 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.402 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.402 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.405 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.565 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 119.2 -0.429 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.532 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.532 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.621 ' HB3' HG13 ' A' ' 476' ' ' VAL . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . 0.454 HD22 ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.454 ' H ' HD22 ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.208 0.448 . . . . 0.0 112.208 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.505 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.664 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.46 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 517' ' ' LEU . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . 0.414 HD13 HD23 ' A' ' 513' ' ' LEU . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . 0.74 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' ARG . . . . . 0.74 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' MET . . . . . 0.459 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' ALA . . . . . 0.401 ' HB3' HD21 ' A' ' 524' ' ' LEU . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' TRP . . . . . 0.541 ' HB3' HD21 ' A' ' 518' ' ' LEU . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 533' ' ' VAL . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 515' ' ' ALA . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 530' ' ' ASP . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' ASP . . . . . 0.405 ' H ' HG22 ' A' ' 527' ' ' ILE . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' VAL . . . . . 0.602 HG22 HD11 ' A' ' 522' ' ' LEU . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' LYS . . . . . 0.478 ' O ' HD12 ' A' ' 522' ' ' LEU . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.429 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.887 0 CA-C-O 119.66 -0.522 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -69.81 172.84 11.95 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 124.412 3.408 . . . . 0.0 113.08 176.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.2 mt -61.83 164.05 6.79 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.574 1.549 . . . . 0.0 112.297 173.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -62.01 158.6 33.56 Favored Glycine 0 CA--C 1.541 1.698 0 O-C-N 121.039 -1.038 . . . . 0.0 113.917 171.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 9.3 t 48.55 47.41 20.46 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.192 1.397 . . . . 0.0 114.055 -176.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 9.4 mtt -48.92 124.09 8.1 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 127.252 2.221 . . . . 0.0 113.319 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 13.0 t -160.1 150.31 18.42 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.014 0.926 . . . . 0.0 112.97 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 44.91 35.39 1.5 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.26 2.224 . . . . 0.0 116.054 176.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 90.5 m -88.28 141.43 30.84 Favored Pre-proline 0 CA--C 1.549 0.935 0 O-C-N 121.264 -0.898 . . . . 0.0 113.24 -178.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.45 6.37 3.62 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 125.048 3.832 . . . . 0.0 114.707 175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -88.86 -19.99 25.18 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.684 1.193 . . . . 0.0 114.207 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -29.85 67.09 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 118.064 0.393 . . . . 0.0 111.725 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -77.62 -44.11 29.35 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.431 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 70.8 mt -59.0 -20.32 51.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.991 0.916 . . . . 0.0 113.402 -176.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -76.98 -46.18 24.84 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.913 0.485 . . . . 0.0 111.8 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.16 -29.5 28.58 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.742 0.817 . . . . 0.0 112.577 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -57.61 -49.85 75.06 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.984 0.811 . . . . 0.0 109.753 173.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 34.7 ttp-105 -52.99 -44.9 67.57 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 120.985 -1.072 . . . . 0.0 112.496 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.518 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -63.06 -34.82 78.41 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 179.17 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.518 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.4 pt-20 -85.72 -30.25 23.28 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 120.373 1.442 . . . . 0.0 112.766 176.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -75.28 -45.91 36.94 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.192 0.997 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 20.5 mt -45.17 -54.91 12.65 Favored Pre-proline 0 CA--C 1.562 1.439 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 172.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.47 -39.85 1.33 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 125.06 3.84 . . . . 0.0 113.753 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.2 -57.43 13.06 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.25 1.02 . . . . 0.0 110.925 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.8 mm? -55.72 -32.4 63.31 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.749 -0.594 . . . . 0.0 111.724 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.97 -34.84 73.84 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.401 -0.812 . . . . 0.0 113.077 177.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.63 -32.29 22.11 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.554 -0.716 . . . . 0.0 112.168 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -79.44 -26.83 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 O-C-N 121.172 -0.955 . . . . 0.0 112.387 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.15 -41.38 75.32 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.401 1.455 . . . . 0.0 112.963 173.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -39.81 88.19 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.508 1.123 . . . . 0.0 111.441 172.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -72.88 -36.53 67.38 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.047 0.939 . . . . 0.0 112.636 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.73 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.9 t -65.95 -41.6 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 125.674 1.589 . . . . 0.0 111.593 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.4 ' HA ' HD11 ' A' ' 485' ' ' LEU . 50.2 t80 -56.41 -54.87 40.5 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.133 1.373 . . . . 0.0 112.639 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.02 -28.32 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 113.564 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.3 t -59.09 -36.21 74.73 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.274 -0.891 . . . . 0.0 112.21 173.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 25.4 tp10 -90.83 -20.84 21.86 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.392 1.077 . . . . 0.0 113.102 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 63.92 39.51 8.07 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.912 1.685 . . . . 0.0 112.741 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -132.42 145.29 56.65 Favored Pre-proline 0 N--CA 1.476 0.839 0 O-C-N 121.311 -0.868 . . . . 0.0 112.438 -174.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.31 -19.13 25.92 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.902 3.068 . . . . 0.0 113.93 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.82 142.47 33.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.18 1.792 . . . . 0.0 109.277 173.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 477' ' ' PHE . 39.9 mt -120.13 132.09 55.28 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.011 0.924 . . . . 0.0 110.888 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.95 157.14 33.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 118.614 0.643 . . . . 0.0 109.898 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.67 -28.85 1.61 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 169.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -71.93 -45.45 61.11 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.069 0.947 . . . . 0.0 112.727 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.86 -51.94 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 122.768 0.427 . . . . 0.0 110.476 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.9 t -60.74 -41.37 88.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.712 -173.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 37.7 t -60.29 -25.14 65.51 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.97 4.77 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.657 -1.277 . . . . 0.0 112.648 169.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.73 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -70.01 -42.52 72.88 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.261 1.024 . . . . 0.0 113.067 -169.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -58.35 -20.97 47.92 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 120.49 -1.382 . . . . 0.0 114.005 172.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 16.2 t -85.87 -49.26 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 124.8 1.24 . . . . 0.0 111.741 172.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -90.12 -40.2 12.4 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 114.865 1.432 . . . . 0.0 114.865 -171.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -69.56 -39.97 77.07 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.818 0.847 . . . . 0.0 112.405 172.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.8 t -63.67 142.0 58.56 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.194 -0.941 . . . . 0.0 111.082 169.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -60.73 -32.98 72.23 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 174.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 59.7 m -106.4 116.71 32.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.953 1.701 . . . . 0.0 112.542 175.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.36 103.35 2.39 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 124.449 1.099 . . . . 0.0 112.966 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 30.2 tp -81.01 152.33 27.99 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.138 0.975 . . . . 0.0 112.717 177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.6 m -72.81 145.75 87.15 Favored Pre-proline 0 CA--C 1.551 1.015 0 C-N-CA 123.91 0.884 . . . . 0.0 113.146 173.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.08 -18.79 40.06 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 123.979 3.12 . . . . 0.0 114.749 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.76 -43.91 72.62 Favored Glycine 0 CA--C 1.538 1.469 0 O-C-N 121.532 -0.73 . . . . 0.0 113.677 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -81.35 -30.99 33.62 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.135 0.974 . . . . 0.0 112.973 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.5 ttp -46.03 -56.3 5.74 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.343 1.057 . . . . 0.0 112.167 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -56.0 -46.39 78.75 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.599 1.16 . . . . 0.0 111.588 -177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -65.22 -31.17 72.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.328 1.851 . . . . 0.0 113.352 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -80.13 -43.11 22.25 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.474 1.034 . . . . 0.0 112.88 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.57 -45.59 81.22 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.37 0.668 . . . . 0.0 111.791 176.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.1 p -69.82 -39.02 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 123.834 0.853 . . . . 0.0 112.13 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.405 ' CD2' HD21 ' A' ' 466' ' ' LEU . 8.7 tt -63.28 -31.46 72.61 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -55.38 -58.4 7.88 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 120.432 1.469 . . . . 0.0 111.389 169.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.75 -32.68 67.7 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.26 -29.36 70.14 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -87.18 -35.62 18.48 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.246 0.93 . . . . 0.0 111.891 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -152.86 104.64 2.67 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 124.597 1.159 . . . . 0.0 111.414 173.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.03 11.36 0.73 Allowed 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 123.514 2.809 . . . . 0.0 113.189 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -102.31 -37.65 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.31 1.844 . . . . 0.0 113.133 -171.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -86.8 -45.09 11.22 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.1 tt -122.84 130.81 53.33 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.989 1.315 . . . . 0.0 110.931 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 16.4 m -129.83 125.69 36.29 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.485 1.114 . . . . 0.0 111.537 178.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -82.72 118.29 23.25 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.473 1.109 . . . . 0.0 108.604 169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -120.2 113.69 20.81 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.594 1.558 . . . . 0.0 111.851 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.02 124.45 29.8 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.708 0.803 . . . . 0.0 109.803 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.65 -164.79 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 124.177 0.991 . . . . 0.0 110.362 172.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -45.8 -42.98 12.84 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 174.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.0 t -150.31 -22.56 0.24 Allowed 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -92.22 173.22 7.93 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.101 1.361 . . . . 0.0 112.394 171.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.7 m -121.59 125.53 46.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.956 0.902 . . . . 0.0 110.367 171.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -105.2 154.12 20.64 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.083 0.953 . . . . 0.0 111.074 169.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 8.6 p -117.32 148.36 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.502 1.121 . . . . 0.0 111.145 170.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -129.06 126.94 40.51 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.568 1.147 . . . . 0.0 110.712 175.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.41 152.37 50.71 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.497 1.919 . . . . 0.0 112.806 173.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -85.32 108.45 17.81 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.703 -0.623 . . . . 0.0 111.212 172.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -67.41 -18.35 65.07 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 171.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -89.83 -2.5 58.23 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.437 1.495 . . . . 0.0 113.844 -174.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.426 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.9 p -65.82 155.01 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.761 1.224 . . . . 0.0 112.226 177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -79.99 109.03 14.05 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.109 169.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -48.97 -48.53 43.16 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.455 1.102 . . . . 0.0 111.847 -173.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.21 -25.38 22.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.695 1.198 . . . . 0.0 114.201 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.02 -44.34 78.21 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.189 0.9 . . . . 0.0 113.676 172.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.516 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.79 -57.93 5.48 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.626 1.213 . . . . 0.0 110.516 -175.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.7 t -57.95 -20.07 35.06 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.361 1.065 . . . . 0.0 113.333 174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.36 -46.62 14.41 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.601 -1.312 . . . . 0.0 114.025 169.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 8.9 ptm85 -77.71 -34.24 52.8 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.024 -1.047 . . . . 0.0 113.594 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -74.38 -19.07 60.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 125.384 1.474 . . . . 0.0 111.579 176.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.46 -23.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.865 2.066 . . . . 0.0 116.427 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -47.98 -36.6 12.91 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 170.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 13.9 m80 -82.55 -32.16 28.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 172.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 48.6 t -61.3 -27.87 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.926 -1.109 . . . . 0.0 111.687 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -17.09 8.18 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.377 1.471 . . . . 0.0 114.545 171.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -55.31 -35.43 65.11 Favored 'General case' 0 CA--C 1.551 0.993 0 O-C-N 120.996 -1.065 . . . . 0.0 113.688 172.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.25 -23.48 11.57 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.95 1.3 . . . . 0.0 113.008 169.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.28 48.76 2.15 Favored Glycine 0 CA--C 1.536 1.393 0 CA-C-O 118.542 -1.143 . . . . 0.0 115.384 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.251 1.151 0 C-N-CA 127.767 2.427 . . . . 0.0 113.97 -177.663 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 CA-C-O 118.469 -1.184 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.77 -177.43 2.2 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.135 3.223 . . . . 0.0 112.486 173.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 3.9 pp -55.24 -20.16 10.22 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 -178.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 169.0 -138.54 5.16 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.436 1.493 . . . . 0.0 112.173 -173.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 15.1 m -56.37 -31.25 63.63 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 8.7 tpt 46.61 26.84 0.57 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 127.233 2.213 . . . . 0.0 115.413 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . 0.314 0.5 OUTLIER 57.12 11.76 1.12 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 -169.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -159.51 46.99 0.28 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -170.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 2.2 t -139.37 129.4 14.33 Favored Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.57 -10.46 26.77 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.675 2.917 . . . . 0.0 114.111 177.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -69.4 -20.43 63.8 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.525 1.511 . . . . 0.0 114.181 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.24 -34.47 70.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.991 0.516 . . . . 0.0 111.702 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -80.19 -42.22 23.77 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.014 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.57 -20.86 35.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -76.6 -45.15 31.42 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.1 0.56 . . . . 0.0 111.704 175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.35 -28.32 29.08 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.398 1.079 . . . . 0.0 112.963 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -57.45 -52.33 65.83 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.127 -0.983 . . . . 0.0 110.305 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.1 ptt-85 -57.63 -34.63 69.53 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.859 -1.151 . . . . 0.0 113.573 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -33.94 74.66 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.57 -31.78 17.43 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.788 1.235 . . . . 0.0 113.291 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -68.98 -49.53 57.01 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 124.171 0.988 . . . . 0.0 111.816 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 38.4 mt -47.82 -52.76 36.8 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-N 120.349 1.431 . . . . 0.0 114.282 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -74.6 -39.11 1.53 Allowed 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.372 3.382 . . . . 0.0 114.162 176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -58.92 -55.98 28.1 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 119.126 0.875 . . . . 0.0 111.385 172.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.588 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -55.27 -31.82 61.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.636 -0.665 . . . . 0.0 111.604 174.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.89 -30.2 71.19 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 120.977 -1.077 . . . . 0.0 113.641 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.62 -27.94 25.11 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.351 -0.843 . . . . 0.0 112.332 176.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.588 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.2 m -89.5 -18.56 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.36 -39.97 80.99 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.95 1.25 . . . . 0.0 111.887 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -39.13 93.57 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.008 0.923 . . . . 0.0 111.839 173.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . 0.407 ' HA ' HG12 ' A' ' 478' ' ' VAL . 69.8 m-80 -68.97 -35.62 76.95 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.454 1.102 . . . . 0.0 112.098 177.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.763 HG13 ' HB3' ' A' ' 493' ' ' ARG . 56.7 t -65.62 -44.11 93.75 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 O-C-N 120.842 -1.161 . . . . 0.0 111.256 170.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.439 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.2 OUTLIER -62.25 -47.83 82.66 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.142 0.977 . . . . 0.0 113.318 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.7 p -76.19 -32.09 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.047 1.339 . . . . 0.0 113.552 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 47.2 t -58.19 -32.34 68.15 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.804 1.183 . . . . 0.0 112.655 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -90.9 -15.64 29.51 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 174.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 49.8 48.29 21.88 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.89 1.676 . . . . 0.0 113.555 -172.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -130.76 147.58 66.69 Favored Pre-proline 0 N--CA 1.48 1.055 0 O-C-N 121.279 -0.888 . . . . 0.0 112.783 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -78.39 -14.1 14.78 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.469 3.446 . . . . 0.0 114.252 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.09 138.54 31.77 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.022 2.129 . . . . 0.0 108.813 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.439 HD11 ' HA ' ' A' ' 477' ' ' PHE . 30.9 mt -113.69 133.45 55.32 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.174 0.589 . . . . 0.0 110.586 175.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 15.0 m -87.54 152.63 22.05 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 177.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -44.87 -27.22 0.5 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.72 -43.33 93.75 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.202 1.001 . . . . 0.0 112.389 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 45.4 t -73.11 -53.22 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 123.956 0.902 . . . . 0.0 110.769 172.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.74 -41.77 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 122.063 -0.398 . . . . 0.0 111.638 -169.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 16.8 t -60.35 -25.45 65.84 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 176.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.94 -53.55 5.03 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.417 1.008 . . . . 0.0 112.68 169.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.763 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.9 OUTLIER -66.01 -42.2 90.02 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.21 1.004 . . . . 0.0 111.832 -169.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -20.18 39.09 Favored 'General case' 0 CA--C 1.554 1.098 0 O-C-N 120.529 -1.357 . . . . 0.0 114.498 170.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.48 -52.8 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 O-C-N 121.115 -0.991 . . . . 0.0 111.509 169.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.64 -39.27 11.4 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -70.25 -37.04 74.84 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.486 0.584 . . . . 0.0 112.252 172.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 53.5 t -68.06 140.57 56.28 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 121.052 -1.03 . . . . 0.0 110.785 169.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -62.37 -27.27 68.95 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 48.8 m -105.93 116.51 32.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.726 1.611 . . . . 0.0 110.889 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.14 123.64 23.32 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.106 -0.996 . . . . 0.0 110.992 172.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 64.3 tp -110.09 153.99 23.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.882 1.673 . . . . 0.0 112.423 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.4 m -67.2 146.93 99.03 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.313 1.445 . . . . 0.0 113.398 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -69.06 -19.62 39.24 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.884 3.056 . . . . 0.0 114.433 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -72.17 -48.94 23.29 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.657 -0.652 . . . . 0.0 113.261 175.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -73.22 -31.46 64.17 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.247 1.019 . . . . 0.0 113.407 176.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -59.52 2.87 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.783 1.233 . . . . 0.0 112.889 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -69.51 -37.69 77.27 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.275 0.63 . . . . 0.0 111.987 -174.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -66.52 -27.25 67.62 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.74 2.016 . . . . 0.0 114.127 176.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -84.48 -38.94 19.49 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.839 1.256 . . . . 0.0 113.108 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.6 mt -61.22 -44.84 96.61 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.637 -0.664 . . . . 0.0 111.634 175.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.0 p -64.11 -36.94 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 121.711 -0.618 . . . . 0.0 111.498 173.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -43.31 90.8 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.11 0.964 . . . . 0.0 113.129 176.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 36.1 mt -54.86 -53.18 58.75 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.393 -0.817 . . . . 0.0 112.567 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -62.76 -27.35 69.23 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -65.41 -31.6 72.78 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 124.94 1.296 . . . . 0.0 112.947 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 5.7 mp -79.11 -36.19 41.06 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.096 0.958 . . . . 0.0 111.868 176.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.93 110.48 2.5 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 125.501 1.52 . . . . 0.0 111.14 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.83 2.62 3.94 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.364 2.709 . . . . 0.0 113.627 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -96.71 -26.9 15.0 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.751 1.621 . . . . 0.0 114.028 -171.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.495 ' CE2' HD21 ' A' ' 535' ' ' LEU . 27.2 t90 -99.94 -51.97 3.56 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.614 0.766 . . . . 0.0 112.834 178.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 14.1 tp -104.59 139.62 39.19 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.343 1.057 . . . . 0.0 109.467 169.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.69 125.83 36.89 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.618 0.767 . . . . 0.0 111.279 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.5 121.29 26.58 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.702 1.201 . . . . 0.0 109.702 169.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -125.15 153.02 43.67 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.239 1.416 . . . . 0.0 113.047 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.08 127.57 50.34 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.348 -1.47 . . . . 0.0 110.778 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.86 -162.73 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 124.197 0.999 . . . . 0.0 111.212 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -44.77 -45.5 10.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.843 1.657 . . . . 0.0 114.683 174.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.6 p -146.25 -22.99 0.44 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.115 1.366 . . . . 0.0 114.546 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.06 174.25 7.75 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.864 2.066 . . . . 0.0 113.361 176.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.8 m -121.83 118.91 30.13 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.26 1.024 . . . . 0.0 110.639 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -110.38 148.11 32.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 122.375 1.083 . . . . 0.0 113.014 175.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.3 t -117.36 142.69 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 124.162 0.985 . . . . 0.0 110.138 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -121.71 126.47 49.0 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.692 0.797 . . . . 0.0 111.448 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.495 HD21 ' CE2' ' A' ' 521' ' ' TRP . 2.1 tm? -132.27 136.39 46.91 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.732 1.613 . . . . 0.0 112.049 -177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -88.46 108.2 19.26 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.532 1.06 . . . . 0.0 110.88 174.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -74.54 -8.87 57.74 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.4 -8.84 57.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.151 1.38 . . . . 0.0 113.852 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.497 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.2 p -66.2 154.87 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.898 0.879 . . . . 0.0 112.003 172.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -78.27 128.36 33.6 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.478 -0.764 . . . . 0.0 109.766 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -51.65 -46.41 63.71 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.684 0.674 . . . . 0.0 111.527 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.73 -21.89 12.28 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.986 1.314 . . . . 0.0 114.344 177.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -72.14 -43.66 47.16 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 123.999 0.809 . . . . 0.0 113.803 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.513 ' H ' HD22 ' A' ' 544' ' ' LEU . 1.3 mm? -69.69 -55.72 9.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 119.082 1.441 . . . . 0.0 111.807 -178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . 0.408 HG22 ' H ' ' A' ' 545' ' ' THR . 0.5 OUTLIER -56.91 -20.03 21.07 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.158 -0.964 . . . . 0.0 113.062 175.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.91 -46.38 21.45 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.356 -1.465 . . . . 0.0 113.525 169.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.39 -39.71 16.12 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -176.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -19.3 61.37 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 112.45 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.16 14.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.728 1.211 . . . . 0.0 114.186 173.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -49.63 -30.15 8.45 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 171.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -82.5 -44.78 15.53 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 171.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -67.4 -24.65 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 120.99 -1.069 . . . . 0.0 113.309 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -52.38 -16.82 0.95 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.598 1.959 . . . . 0.0 114.531 170.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.22 -37.63 36.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.358 1.063 . . . . 0.0 113.233 169.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -109.26 -23.67 11.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 125.972 1.709 . . . . 0.0 113.973 170.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 96.52 39.3 4.22 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 116.853 1.501 . . . . 0.0 116.853 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.127 0 C-N-CA 127.876 2.471 . . . . 0.0 114.36 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 CA-C-O 119.67 -0.517 . . . . 0.0 112.198 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.49 132.63 41.63 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 124.002 3.134 . . . . 0.0 111.791 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 49.09 32.78 4.25 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 125.897 1.679 . . . . 0.0 112.755 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 76.69 -64.51 2.96 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.781 1.657 . . . . 0.0 111.663 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 54.4 m -146.51 95.78 2.66 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.236 1.814 . . . . 0.0 111.558 176.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -55.24 108.26 0.4 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.987 1.315 . . . . 0.0 111.871 171.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.4 m 34.14 70.99 0.11 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.381 2.272 . . . . 0.0 115.1 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 51.3 mtt85 54.89 44.34 28.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.127 1.371 . . . . 0.0 113.927 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.79 127.12 67.16 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 124.51 1.124 . . . . 0.0 113.509 -172.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.5 -12.61 35.28 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.208 2.606 . . . . 0.0 114.156 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.79 -24.12 65.28 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.197 1.362 . . . . 0.0 114.152 169.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.24 -35.35 71.58 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 119.129 0.877 . . . . 0.0 112.0 -177.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -79.73 -40.32 29.16 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 117.999 -1.001 . . . . 0.0 112.417 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 65.7 mt -53.85 -24.57 16.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.172 0.897 . . . . 0.0 113.396 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.44 -45.13 40.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.401 0.68 . . . . 0.0 112.352 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.2 pp -83.23 -30.07 27.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 175.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -58.45 -56.18 25.49 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.549 1.068 . . . . 0.0 110.179 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.84 -35.55 64.09 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.992 -1.067 . . . . 0.0 113.365 177.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.483 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.43 -37.51 87.79 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.302 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.483 ' N ' HD23 ' A' ' 463' ' ' LEU . 8.0 pt-20 -86.08 -31.29 22.0 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 120.74 1.609 . . . . 0.0 113.438 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -50.14 37.75 Favored 'General case' 0 C--O 1.217 -0.63 0 C-N-CA 125.032 1.333 . . . . 0.0 110.459 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 47.2 mt -49.68 -52.79 47.86 Favored Pre-proline 0 CA--C 1.559 1.304 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -71.23 -40.34 3.26 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 124.201 3.267 . . . . 0.0 113.589 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -63.09 -55.45 25.3 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.684 -0.635 . . . . 0.0 111.587 173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.546 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.5 mm? -54.01 -35.02 61.45 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.883 -0.51 . . . . 0.0 111.561 174.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.68 99.61 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 175.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.11 -34.55 56.74 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.019 -1.051 . . . . 0.0 112.711 178.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -81.73 -24.05 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.37 -38.94 66.7 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 120.337 1.426 . . . . 0.0 112.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.77 -43.4 94.36 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.849 1.26 . . . . 0.0 111.432 173.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -31.75 71.08 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.417 1.087 . . . . 0.0 111.656 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.72 HG13 ' HB3' ' A' ' 493' ' ' ARG . 55.5 t -71.76 -43.55 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.548 1.139 . . . . 0.0 111.915 175.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -68.32 -40.1 81.76 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.53 -36.05 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.24 -0.913 . . . . 0.0 113.443 176.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.1 m -62.0 -30.11 70.72 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.896 1.226 . . . . 0.0 113.106 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.78 -8.49 49.56 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.223 1.409 . . . . 0.0 114.153 173.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.18 37.65 18.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 126.036 1.734 . . . . 0.0 114.558 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -126.03 147.03 57.74 Favored Pre-proline 0 CA--C 1.549 0.934 0 O-C-N 120.868 -1.145 . . . . 0.0 112.672 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -76.11 -18.86 16.11 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.142 3.228 . . . . 0.0 113.834 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.84 141.75 33.11 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.405 1.882 . . . . 0.0 109.6 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 45.9 mt -121.69 138.03 54.51 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.314 1.046 . . . . 0.0 110.467 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.83 154.82 29.53 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -46.49 -29.57 1.82 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 169.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -68.85 -40.75 79.22 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.269 1.028 . . . . 0.0 112.652 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.6 t -70.16 -53.12 24.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 122.952 0.501 . . . . 0.0 110.798 170.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.3 t -59.54 -44.52 93.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.144 -169.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 68.8 m -63.02 -19.54 64.46 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.03 -51.8 6.11 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.106 1.321 . . . . 0.0 111.643 169.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.72 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.3 mpt_? -68.35 -45.39 72.95 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.894 1.278 . . . . 0.0 112.641 -171.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.12 -26.08 4.15 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 170.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 12.9 t -86.04 -55.86 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.659 1.183 . . . . 0.0 112.145 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.74 -34.23 13.99 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -171.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.5 t -72.05 -43.37 65.03 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.348 0.522 . . . . 0.0 112.02 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 35.1 m -71.57 151.85 43.46 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.287 -0.883 . . . . 0.0 112.873 179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -61.37 -31.53 71.42 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 176.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.3 m -106.44 128.44 54.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.176 1.39 . . . . 0.0 111.631 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.54 34.6 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.562 1.145 . . . . 0.0 110.631 169.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 55.9 tp -121.36 155.66 34.28 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.999 1.719 . . . . 0.0 112.455 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.9 m -75.1 138.26 72.4 Favored Pre-proline 0 CA--C 1.548 0.903 0 O-C-N 121.111 -0.993 . . . . 0.0 111.966 175.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -64.96 -27.62 58.24 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.417 2.744 . . . . 0.0 114.067 -175.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.68 -36.18 90.91 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 123.684 0.659 . . . . 0.0 114.141 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -86.01 -36.42 19.77 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.258 1.023 . . . . 0.0 112.151 173.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.67 -39.74 74.28 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.09 -46.44 75.5 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 121.261 -0.9 . . . . 0.0 112.416 172.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 11.0 mmpt? -66.43 -33.72 76.35 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.624 1.569 . . . . 0.0 113.552 176.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -77.38 -39.12 48.37 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.989 -1.069 . . . . 0.0 113.6 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.67 -44.96 95.96 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.382 -0.824 . . . . 0.0 111.519 173.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -39.57 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 122.8 0.44 . . . . 0.0 111.375 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 54.2 tp -52.69 -48.01 66.85 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.284 0.634 . . . . 0.0 112.56 176.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 23.8 mt -52.86 -52.88 55.65 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.199 0.908 . . . . 0.0 112.714 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.76 -27.07 67.7 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.27 -20.33 61.54 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 46.3 mt -92.32 -32.19 15.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 119.036 0.834 . . . . 0.0 112.331 175.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.08 108.4 2.47 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 125.075 1.35 . . . . 0.0 111.229 170.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.46 1.58 4.76 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.132 2.554 . . . . 0.0 113.651 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -86.86 -44.39 11.74 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.456 1.502 . . . . 0.0 112.862 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -89.31 -44.68 10.05 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -115.98 130.52 56.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.211 1.404 . . . . 0.0 109.782 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.5 m -129.69 125.7 36.57 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.946 0.898 . . . . 0.0 111.598 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -84.97 115.3 22.73 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.56 1.544 . . . . 0.0 110.465 170.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 25.6 m80 -122.8 152.87 40.25 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.76 1.624 . . . . 0.0 112.473 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -123.25 125.25 44.74 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.681 -1.262 . . . . 0.0 110.351 -175.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -163.59 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 123.897 0.879 . . . . 0.0 111.712 175.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -46.33 -39.43 10.18 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.934 1.694 . . . . 0.0 115.271 174.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 7.7 t -153.29 -22.61 0.15 Allowed 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -90.07 174.03 7.86 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.756 1.622 . . . . 0.0 113.042 172.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 12.1 m -123.8 120.87 33.91 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.547 1.539 . . . . 0.0 110.56 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -109.74 142.35 41.07 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.031 0.933 . . . . 0.0 113.348 173.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 53.3 t -104.51 144.88 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.307 1.043 . . . . 0.0 108.229 173.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -119.85 126.94 52.19 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.503 1.121 . . . . 0.0 110.139 171.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -134.44 133.74 40.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.291 1.836 . . . . 0.0 110.741 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -87.94 108.22 19.09 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 119.343 0.974 . . . . 0.0 110.865 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -72.01 -16.01 62.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.623 1.169 . . . . 0.0 113.899 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.73 -6.1 59.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.429 1.091 . . . . 0.0 113.918 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.431 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -65.51 155.27 6.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.902 1.281 . . . . 0.0 112.79 176.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -80.61 106.76 12.87 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.309 -0.869 . . . . 0.0 110.877 169.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -47.28 -46.59 24.92 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.196 1.398 . . . . 0.0 112.454 -174.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.15 44.62 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -68.67 -44.4 71.08 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.552 1.072 . . . . 0.0 113.599 171.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.529 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -69.9 -57.56 4.9 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.196 1.399 . . . . 0.0 110.458 -174.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.4 t -56.96 -19.31 17.37 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 173.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -46.58 14.72 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 120.185 1.357 . . . . 0.0 113.801 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -78.45 -32.57 48.55 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -19.14 53.69 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 125.552 1.541 . . . . 0.0 111.945 177.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.02 -23.36 0.14 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -49.87 -29.5 8.24 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -82.48 -41.25 20.0 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 170.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.45 -28.97 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 125.244 1.418 . . . . 0.0 112.82 174.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -54.28 -17.0 2.47 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 171.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.19 -41.2 36.07 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.429 1.092 . . . . 0.0 113.481 169.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -109.2 -23.37 11.65 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.347 1.459 . . . . 0.0 113.968 169.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.44 49.9 2.68 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 118.82 -0.989 . . . . 0.0 115.125 170.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.867 2.467 . . . . 0.0 114.113 -175.585 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 CA-C-O 119.237 -0.757 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -83.79 27.14 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.895 3.73 . . . . 0.0 114.613 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 76.96 -41.51 0.39 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.123 2.169 . . . . 0.0 113.915 169.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 166.94 -62.36 0.21 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 126.112 1.815 . . . . 0.0 113.901 170.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 75.4 m -97.92 70.28 2.13 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.027 1.331 . . . . 0.0 113.238 -175.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.0 ttp -63.83 145.99 54.77 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.485 -0.76 . . . . 0.0 112.263 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.0 m 54.26 55.61 7.95 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 125.178 1.391 . . . . 0.0 114.502 176.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.2 13.13 2.01 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 175.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -152.36 146.68 18.61 Favored Pre-proline 0 N--CA 1.476 0.833 0 O-C-N 120.426 -1.422 . . . . 0.0 113.169 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.65 -28.46 44.5 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.237 2.625 . . . . 0.0 113.178 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.43 -31.33 72.01 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.34 -32.26 71.23 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.71 0.686 . . . . 0.0 112.241 177.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -86.51 -49.54 7.51 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-O 117.636 -1.174 . . . . 0.0 113.49 177.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.1 pp -58.04 -23.22 53.46 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.163 1.347 . . . . 0.0 113.009 -175.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -78.07 -37.1 47.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.245 1.018 . . . . 0.0 112.985 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.87 -32.44 27.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.727 -0.608 . . . . 0.0 111.868 173.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -61.0 -40.77 94.77 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.26 -0.9 . . . . 0.0 111.117 174.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -64.46 -41.82 96.3 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.304 -0.873 . . . . 0.0 113.122 170.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.0 -35.65 79.17 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 179.028 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.568 ' N ' HD23 ' A' ' 463' ' ' LEU . 3.0 pp20? -85.92 -33.09 21.28 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.714 1.206 . . . . 0.0 113.197 -177.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -75.05 -41.84 58.3 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-O 117.936 -1.03 . . . . 0.0 111.958 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 513' ' ' LEU . 22.6 mt -46.81 -51.86 35.87 Favored Pre-proline 0 CA--C 1.562 1.42 0 CA-C-N 121.542 1.974 . . . . 0.0 115.24 176.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -74.02 -39.64 1.64 Allowed 'Trans proline' 0 C--N 1.35 0.637 1 C-N-CA 125.414 4.076 . . . . 0.0 113.166 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -66.42 -56.41 11.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.507 0.723 . . . . 0.0 112.505 176.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.5 mm? -53.14 -36.17 60.54 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.086 0.955 . . . . 0.0 111.298 173.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.84 -41.47 95.88 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 119.038 0.835 . . . . 0.0 112.927 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -75.63 -36.64 60.17 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.12 -0.987 . . . . 0.0 112.589 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.1 m -80.24 -23.19 11.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.435 -0.79 . . . . 0.0 112.033 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.54 -40.73 68.96 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.826 1.251 . . . . 0.0 112.829 175.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -56.69 -45.24 81.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.182 1.393 . . . . 0.0 110.694 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -68.22 -35.78 78.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.355 1.062 . . . . 0.0 112.43 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.698 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.3 t -65.17 -43.86 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 121.064 -1.022 . . . . 0.0 112.162 173.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.8 -45.01 95.7 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.861 0.864 . . . . 0.0 112.581 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.6 p -76.61 -32.04 20.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 125.501 1.521 . . . . 0.0 113.825 176.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 45.7 t -58.86 -31.22 68.35 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.695 1.134 . . . . 0.0 112.828 174.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -90.75 -19.1 23.89 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.293 1.037 . . . . 0.0 113.366 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 50.45 51.19 17.32 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 -171.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -134.11 147.19 62.89 Favored Pre-proline 0 CA--C 1.549 0.91 0 O-C-N 121.456 -0.778 . . . . 0.0 112.643 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -80.14 -12.5 13.03 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.169 3.246 . . . . 0.0 113.711 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.23 129.6 21.18 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.343 1.857 . . . . 0.0 109.616 172.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.6 mp -115.52 136.08 53.44 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.42 1.088 . . . . 0.0 109.102 176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.4 m -87.28 156.27 19.71 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.0 -28.47 1.17 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 169.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.57 -44.16 94.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.994 1.318 . . . . 0.0 112.52 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 42.8 t -75.62 -52.88 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.688 0.795 . . . . 0.0 111.08 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 20.4 t -58.84 -42.13 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.317 0.508 . . . . 0.0 110.73 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 19.1 t -60.43 -29.13 68.8 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.757 1.392 . . . . 0.0 114.757 174.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -83.59 -41.2 18.13 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.17 -1.581 . . . . 0.0 112.938 173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.698 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.5 tpt180 -80.92 -43.82 19.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.588 1.155 . . . . 0.0 111.223 -170.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.481 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 8.7 ptm -59.23 -20.5 54.57 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 120.852 -1.155 . . . . 0.0 114.021 171.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 55.5 t -85.87 -55.64 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 125.282 1.433 . . . . 0.0 112.011 174.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -92.79 -35.85 13.19 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 -174.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 6.6 t -73.61 -36.91 65.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.948 0.795 . . . . 0.0 112.556 175.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.5 m -74.4 150.49 40.0 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.299 -0.876 . . . . 0.0 113.006 173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.64 -30.46 71.38 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.9 m -106.33 124.73 50.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.516 1.527 . . . . 0.0 111.344 172.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -80.5 105.44 11.75 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.021 0.929 . . . . 0.0 111.842 172.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 44.8 tp -82.23 148.6 28.31 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 121.073 -1.017 . . . . 0.0 112.416 176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 35.2 m -65.54 142.79 98.45 Favored Pre-proline 0 CA--C 1.551 1.009 0 O-C-N 121.043 -1.036 . . . . 0.0 113.018 175.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.36 -22.68 45.4 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 123.726 2.951 . . . . 0.0 114.159 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.58 -40.0 13.53 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 123.768 0.699 . . . . 0.0 113.961 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.9 -34.68 57.7 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.167 0.984 . . . . 0.0 112.743 177.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -34.98 72.97 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -67.36 -32.44 73.36 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 121.376 -0.828 . . . . 0.0 112.528 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -79.36 -28.39 41.97 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.886 1.674 . . . . 0.0 112.76 171.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -82.59 -46.48 13.27 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.749 -1.219 . . . . 0.0 114.011 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.1 mt -52.78 -41.67 64.31 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.665 0.786 . . . . 0.0 111.199 173.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.9 p -74.61 -40.78 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.047 0.539 . . . . 0.0 112.392 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.774 HD11 HD21 ' A' ' 466' ' ' LEU . 0.4 OUTLIER -65.53 -29.6 70.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.106 0.866 . . . . 0.0 113.147 -178.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.23 -57.99 8.6 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 119.197 0.908 . . . . 0.0 111.921 172.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.68 -33.42 70.12 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -64.87 -24.6 67.59 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.3 mp -91.34 -35.41 14.44 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.837 1.255 . . . . 0.0 112.148 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -149.35 105.16 3.31 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.751 1.22 . . . . 0.0 111.562 172.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.77 8.97 1.12 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.485 2.79 . . . . 0.0 113.578 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -99.92 -38.21 8.71 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.343 1.857 . . . . 0.0 113.388 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.8 t90 -88.24 -46.51 9.18 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 6.4 tt -120.95 132.6 55.04 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.761 1.224 . . . . 0.0 110.628 -178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 19.4 m -129.96 126.31 37.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.957 0.903 . . . . 0.0 111.889 178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -82.85 120.17 25.31 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.112 1.365 . . . . 0.0 109.145 169.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -125.26 122.67 37.62 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.824 1.25 . . . . 0.0 111.511 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 127.06 35.59 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.571 -1.331 . . . . 0.0 110.322 175.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -163.43 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 124.055 0.942 . . . . 0.0 111.324 170.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 81.7 mtt-85 -44.07 -45.22 7.94 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.835 1.654 . . . . 0.0 114.631 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.7 p -147.03 -22.75 0.4 Allowed 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.309 1.444 . . . . 0.0 114.777 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -94.23 173.86 7.43 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 126.653 1.981 . . . . 0.0 113.075 175.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.4 m -122.39 118.97 29.68 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.538 1.135 . . . . 0.0 110.671 173.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -101.32 151.51 21.81 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 122.2 1.0 . . . . 0.0 112.319 170.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 42.6 t -117.26 140.9 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 124.676 1.19 . . . . 0.0 109.489 175.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -119.99 126.88 51.92 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.357 1.063 . . . . 0.0 110.368 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.07 152.28 50.53 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.627 1.571 . . . . 0.0 112.263 172.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -86.42 108.37 18.46 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.181 -0.949 . . . . 0.0 111.025 171.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 pttt -70.62 -15.24 62.73 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.332 1.053 . . . . 0.0 113.551 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.58 -2.23 56.31 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.274 1.43 . . . . 0.0 114.024 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.433 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -66.2 155.18 7.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.017 1.327 . . . . 0.0 112.46 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -79.33 104.67 10.11 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.519 -0.738 . . . . 0.0 110.131 169.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -47.9 -45.33 30.48 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.848 1.259 . . . . 0.0 112.325 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.09 45.95 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.15 -41.76 92.07 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.692 1.139 . . . . 0.0 113.743 171.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.507 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -71.8 -57.82 4.01 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.101 1.36 . . . . 0.0 110.077 -173.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -57.76 -19.83 30.76 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 173.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -79.82 -40.74 27.88 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -86.0 -28.82 23.95 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.415 HD11 HD22 ' A' ' 466' ' ' LEU . 0.1 OUTLIER -81.01 -20.01 42.7 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.639 1.576 . . . . 0.0 112.062 173.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.19 -23.14 0.3 Allowed 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -51.11 -30.99 17.84 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.197 0.999 . . . . 0.0 113.45 171.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.51 -39.49 22.35 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 170.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.2 t -56.58 -29.29 29.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 125.329 1.451 . . . . 0.0 112.697 173.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.86 -17.4 1.37 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 169.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.89 64.93 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 171.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -108.98 -23.55 11.64 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 125.345 1.458 . . . . 0.0 113.162 169.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.84 50.24 1.98 Allowed Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 169.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 N--CA 1.487 1.393 0 C-N-CA 129.405 3.082 . . . . 0.0 112.427 170.829 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 CA-C-O 118.501 -1.166 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.94 -47.48 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.667 2.911 . . . . 0.0 114.34 -171.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pp 178.56 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 128.167 2.587 . . . . 0.0 112.706 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 158.98 -32.51 0.47 Allowed Glycine 0 CA--C 1.538 1.51 0 N-CA-C 116.083 1.193 . . . . 0.0 116.083 174.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 36.8 p -155.79 64.42 0.59 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 2.7 tpt -57.59 -28.41 63.59 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -175.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.4 m -76.89 -6.96 54.56 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.708 1.603 . . . . 0.0 114.909 -174.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -147.75 48.93 1.08 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.124 1.37 . . . . 0.0 113.688 -169.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 99.7 m -121.44 60.18 9.96 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 126.038 1.735 . . . . 0.0 112.244 174.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -62.41 -14.01 36.4 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.611 2.874 . . . . 0.0 114.404 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -66.16 -21.01 66.31 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 170.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -27.3 69.26 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.97 0.908 . . . . 0.0 112.199 176.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . 0.471 ' HB2' HE21 ' A' ' 461' ' ' GLN . 4.6 pt-20 -86.12 -41.84 14.39 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 118.176 -0.916 . . . . 0.0 112.796 174.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -54.08 -24.27 16.88 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -83.66 -38.43 21.53 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.01 0.924 . . . . 0.0 112.996 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.18 -34.11 26.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.766 0.826 . . . . 0.0 112.989 176.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . 0.471 HE21 ' HB2' ' A' ' 457' ' ' GLU . 35.6 mm-40 -63.32 -51.49 65.8 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.622 -1.299 . . . . 0.0 110.075 176.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.76 -31.58 68.5 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.676 -1.265 . . . . 0.0 113.335 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -35.18 75.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -85.89 -29.11 23.92 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.572 1.149 . . . . 0.0 112.645 173.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 67.6 mmt-85 -67.11 -50.97 59.65 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.077 0.951 . . . . 0.0 111.523 176.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 25.8 mt -48.05 -52.72 38.6 Favored Pre-proline 0 CA--C 1.562 1.428 0 CA-C-N 120.618 1.554 . . . . 0.0 114.933 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -72.82 -38.97 2.67 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 113.768 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -60.77 -54.92 39.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.624 1.17 . . . . 0.0 111.918 172.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.33 -33.73 54.64 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.963 0.905 . . . . 0.0 111.411 176.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.73 -41.02 94.48 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -33.79 30.34 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 121.457 -0.777 . . . . 0.0 112.675 -178.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.54 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.6 m -78.16 -26.63 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.228 -0.92 . . . . 0.0 113.066 177.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.57 -36.69 74.35 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.615 1.098 . . . . 0.0 113.297 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -57.21 -44.37 83.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.465 0.706 . . . . 0.0 110.489 172.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.94 -36.43 72.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.254 1.021 . . . . 0.0 112.395 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 493' ' ' ARG . 52.5 t -67.38 -44.01 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.197 -0.939 . . . . 0.0 111.821 175.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -59.1 -45.93 89.6 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.592 1.157 . . . . 0.0 112.279 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.8 p -77.07 -29.52 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.719 1.208 . . . . 0.0 114.139 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.8 t -58.95 -34.73 72.1 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.864 1.211 . . . . 0.0 112.135 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -86.88 -21.93 26.04 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 71.96 33.54 1.65 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.813 1.645 . . . . 0.0 111.768 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -136.77 153.04 75.4 Favored Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 124.633 1.173 . . . . 0.0 113.295 -170.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -77.09 -16.08 15.97 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.934 3.089 . . . . 0.0 114.229 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.11 143.32 32.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.426 1.491 . . . . 0.0 111.024 171.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.2 mp -124.06 135.04 53.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.386 1.475 . . . . 0.0 109.332 -178.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.8 158.87 21.55 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.895 0.878 . . . . 0.0 109.036 176.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.92 -28.74 1.71 Allowed 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 170.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -67.45 -45.47 75.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.694 1.198 . . . . 0.0 112.054 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.31 -53.06 36.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 123.463 0.705 . . . . 0.0 110.561 171.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.9 -41.34 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 118.869 -0.586 . . . . 0.0 110.72 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 32.1 t -60.31 -25.2 65.59 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.66 -48.99 8.35 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 120.392 -1.443 . . . . 0.0 112.902 169.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.657 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -75.39 -45.74 37.19 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.255 1.022 . . . . 0.0 113.083 -169.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 2.4 ppp? -56.81 -22.0 33.02 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 120.861 -1.15 . . . . 0.0 114.038 172.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 48.4 t -85.86 -54.22 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.816 1.246 . . . . 0.0 112.086 175.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.85 -35.05 13.58 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 10.3 t -71.68 -39.71 70.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.959 0.8 . . . . 0.0 112.327 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 18.5 m -71.92 147.5 46.97 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.435 -0.791 . . . . 0.0 112.508 175.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -62.57 -31.52 72.34 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 177.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.8 m -106.23 116.83 32.61 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.097 1.359 . . . . 0.0 111.504 173.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.96 125.91 28.41 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.277 1.031 . . . . 0.0 110.962 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 49.2 tp -117.27 148.28 41.81 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.489 1.516 . . . . 0.0 112.915 178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 45.3 m -68.7 145.21 96.82 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.806 1.242 . . . . 0.0 113.156 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -66.08 -24.37 52.28 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.891 3.06 . . . . 0.0 114.609 -176.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.35 -39.84 87.43 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 123.646 0.641 . . . . 0.0 113.675 176.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -81.13 -36.53 30.18 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.154 0.982 . . . . 0.0 112.522 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 11.2 ttp -46.45 -56.31 6.13 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.462 1.105 . . . . 0.0 111.943 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -59.68 -45.56 91.71 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.843 0.857 . . . . 0.0 111.85 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 6.2 mmpt? -62.58 -27.49 69.22 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.992 1.717 . . . . 0.0 114.479 175.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -83.1 -41.13 18.93 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.471 1.108 . . . . 0.0 113.509 172.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 80.2 mt -58.92 -45.33 90.64 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.54 -0.725 . . . . 0.0 111.441 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.7 p -67.38 -37.0 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.511 0.724 . . . . 0.0 112.04 176.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -40.43 69.32 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.394 1.078 . . . . 0.0 112.962 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 74.9 mt -59.66 -55.81 29.73 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.096 0.558 . . . . 0.0 112.025 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -56.98 -32.05 65.68 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.27 -30.16 71.35 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.935 1.294 . . . . 0.0 113.683 172.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.6 mp -87.16 -34.96 18.87 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.704 1.201 . . . . 0.0 111.97 178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -154.51 107.56 2.38 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 124.938 1.295 . . . . 0.0 111.508 172.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 11.89 0.75 Allowed 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.844 3.03 . . . . 0.0 113.454 174.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -99.62 -47.4 5.11 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.839 1.656 . . . . 0.0 112.574 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -77.72 -43.85 29.69 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.7 tt -126.06 132.2 51.99 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.926 1.29 . . . . 0.0 110.958 -175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 62.8 m -129.68 125.63 36.44 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.468 1.107 . . . . 0.0 112.145 177.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -83.56 117.96 23.48 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.332 1.453 . . . . 0.0 108.942 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -124.08 152.54 42.58 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.047 1.339 . . . . 0.0 111.999 -174.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -121.5 124.92 45.58 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 120.229 -1.544 . . . . 0.0 111.143 -173.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -162.48 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 124.175 0.99 . . . . 0.0 111.712 175.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -45.62 -44.3 13.0 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.29 1.836 . . . . 0.0 114.592 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 35.3 p -147.07 -22.9 0.4 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.287 1.435 . . . . 0.0 114.63 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -90.49 175.03 7.22 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.553 1.941 . . . . 0.0 113.59 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.2 m -121.87 121.11 36.42 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.448 1.499 . . . . 0.0 110.419 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -108.25 145.82 33.75 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.289 1.035 . . . . 0.0 112.569 172.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.4 p -114.93 143.99 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 O-C-N 121.159 -0.963 . . . . 0.0 110.824 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -125.37 128.65 48.49 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.086 1.354 . . . . 0.0 110.505 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -130.98 152.51 50.21 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.048 1.739 . . . . 0.0 111.89 171.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -84.81 108.29 17.41 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.25 -0.906 . . . . 0.0 110.494 171.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -69.08 -17.95 63.93 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.33 -2.35 57.39 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.788 1.635 . . . . 0.0 113.565 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.417 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.9 p -64.81 155.11 6.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.172 1.389 . . . . 0.0 111.832 175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -77.72 104.67 8.41 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.326 -0.859 . . . . 0.0 109.955 171.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -47.69 -47.74 29.63 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.273 1.029 . . . . 0.0 111.964 -172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.18 -27.51 21.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.767 1.227 . . . . 0.0 114.014 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -65.01 -43.24 96.14 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.526 1.06 . . . . 0.0 113.814 171.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.497 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.5 mm? -73.4 -57.74 3.79 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.652 1.581 . . . . 0.0 109.977 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 9.3 t -56.12 -19.07 11.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.675 1.19 . . . . 0.0 114.153 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -84.06 -46.3 12.13 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.786 1.176 . . . . 0.0 113.376 169.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -77.46 -43.12 33.46 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.218 -0.926 . . . . 0.0 113.312 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -19.33 64.32 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.71 1.204 . . . . 0.0 112.314 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.04 -23.06 4.66 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.824 1.25 . . . . 0.0 113.925 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -50.33 -32.6 17.65 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 174.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -82.35 -41.12 20.43 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.144 0.978 . . . . 0.0 113.41 174.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.38 -24.83 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 O-C-N 121.218 -0.926 . . . . 0.0 113.01 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -51.1 -17.14 0.57 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.557 1.943 . . . . 0.0 115.004 175.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.54 -33.81 33.71 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.729 1.612 . . . . 0.0 113.918 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -109.26 -22.59 12.0 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.368 1.467 . . . . 0.0 113.893 169.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.73 47.05 4.96 Favored Glycine 0 CA--C 1.538 1.496 0 N-CA-C 115.797 1.079 . . . . 0.0 115.797 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.556 1.21 0 C-N-CA 127.248 2.219 . . . . 0.0 113.311 -177.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 CA-C-O 119.701 -0.5 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.67 177.22 5.01 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 124.424 3.416 . . . . 0.0 113.239 176.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.06 3.89 0.53 Allowed 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 127.572 2.349 . . . . 0.0 115.992 -174.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 168.32 -161.95 35.7 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 127.12 2.295 . . . . 0.0 111.64 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 20.9 m -63.98 -11.75 31.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 171.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 13.2 mmt 48.6 65.69 1.28 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.639 1.976 . . . . 0.0 114.089 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 47.1 p -129.31 142.36 50.85 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.971 1.708 . . . . 0.0 111.628 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.69 57.9 0.42 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 127.362 2.265 . . . . 0.0 116.749 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 16.8 m -125.53 150.29 67.5 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.525 1.53 . . . . 0.0 113.377 -174.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -67.93 -16.14 44.93 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.251 3.3 . . . . 0.0 114.379 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -73.11 -20.37 60.95 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.84 1.2 . . . . 0.0 113.937 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.64 -35.39 70.44 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.85 1.205 . . . . 0.0 112.496 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.0 -39.5 55.68 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.586 0.754 . . . . 0.0 112.248 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.8 mt -58.04 -17.44 17.72 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.788 1.235 . . . . 0.0 113.966 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.74 -48.7 14.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 171.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.3 pp -83.02 -28.26 29.77 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -177.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -60.01 -54.79 41.83 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.935 -1.103 . . . . 0.0 110.629 175.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 21.6 ptt-85 -56.94 -34.64 68.19 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.025 -1.047 . . . . 0.0 112.769 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -34.88 79.35 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -86.2 -30.21 22.59 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.839 1.2 . . . . 0.0 113.188 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 41.7 mmt-85 -73.81 -45.85 48.9 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.317 1.047 . . . . 0.0 111.673 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 20.9 mt -48.3 -53.87 30.5 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 172.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -72.27 -38.4 3.7 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 124.319 3.346 . . . . 0.0 113.88 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.98 -54.25 48.22 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.447 1.099 . . . . 0.0 111.345 172.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.526 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.8 mm? -58.05 -29.87 65.72 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.147 0.579 . . . . 0.0 112.166 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -58.38 -37.47 75.32 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.744 0.702 . . . . 0.0 112.562 175.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -29.91 23.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.64 -0.662 . . . . 0.0 112.776 -177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.526 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.3 m -80.81 -28.06 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 O-C-N 121.522 -0.736 . . . . 0.0 112.233 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 2.0 mp -55.56 -38.1 68.89 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.254 1.388 . . . . 0.0 113.148 174.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -44.46 97.33 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.526 1.13 . . . . 0.0 110.97 174.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -68.57 -33.99 75.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.059 0.944 . . . . 0.0 112.492 176.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.609 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.1 t -70.63 -38.44 73.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 125.009 1.323 . . . . 0.0 111.911 177.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -56.2 -53.14 60.72 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.199 1.0 . . . . 0.0 111.916 169.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.4 p -77.33 -30.44 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 123.527 0.731 . . . . 0.0 112.136 -170.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 15.7 t -58.91 -34.88 72.2 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.447 -0.783 . . . . 0.0 112.286 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -91.16 -7.2 52.16 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.15 1.38 . . . . 0.0 114.285 175.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? 55.41 25.23 7.43 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 127.048 2.139 . . . . 0.0 115.549 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -146.33 152.78 47.16 Favored Pre-proline 0 N--CA 1.478 0.96 0 O-C-N 120.709 -1.244 . . . . 0.0 114.047 -171.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -81.74 -10.55 11.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.122 3.215 . . . . 0.0 115.781 -176.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -131.11 124.17 30.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.121 0.968 . . . . 0.0 109.589 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 6.0 mp -125.59 128.93 48.67 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.634 1.173 . . . . 0.0 108.125 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.44 158.25 34.18 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 119.206 0.912 . . . . 0.0 109.917 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -45.94 -28.32 1.1 Allowed 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 169.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -72.39 -43.18 64.3 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.877 0.871 . . . . 0.0 112.423 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.8 -54.5 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.313 0.645 . . . . 0.0 110.513 170.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 18.6 t -62.2 -43.8 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.891 -169.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 48.5 t -56.89 -43.63 81.49 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.836 1.198 . . . . 0.0 113.138 173.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -72.12 -43.92 63.96 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.609 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.2 OUTLIER -77.04 -42.82 36.88 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 120.627 -1.296 . . . . 0.0 112.083 -177.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.43 -31.92 64.38 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.461 -1.399 . . . . 0.0 113.856 170.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.9 p -86.22 -43.18 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 CA-C-N 119.967 1.258 . . . . 0.0 113.411 178.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -92.78 -35.38 13.45 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.9 t -76.67 -37.45 56.18 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.129 0.877 . . . . 0.0 112.858 175.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 47.1 t -60.69 141.98 56.24 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.934 -1.104 . . . . 0.0 111.11 169.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.94 -32.36 67.73 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.2 m -106.06 116.88 32.69 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.839 1.656 . . . . 0.0 111.809 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.39 103.28 5.46 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 120.821 -1.175 . . . . 0.0 112.518 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 54.2 tp -80.69 153.64 27.76 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.823 1.249 . . . . 0.0 112.088 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 29.4 m -59.11 137.19 88.1 Favored Pre-proline 0 CA--C 1.55 0.965 0 O-C-N 120.95 -1.094 . . . . 0.0 112.481 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.9 -18.88 46.84 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.585 2.857 . . . . 0.0 113.939 -177.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.93 -38.37 16.04 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.838 0.732 . . . . 0.0 113.719 172.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -69.27 -41.39 76.93 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.884 0.873 . . . . 0.0 112.43 174.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -29.32 66.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -59.56 -39.66 84.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 120.031 1.287 . . . . 0.0 112.482 173.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -79.07 -24.8 43.27 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.673 1.989 . . . . 0.0 113.033 177.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -84.45 -40.94 17.14 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.519 1.128 . . . . 0.0 113.922 173.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 21.3 mt -57.75 -42.86 84.81 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.447 1.021 . . . . 0.0 112.583 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . 0.456 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -67.57 -35.4 72.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 123.759 0.823 . . . . 0.0 112.177 174.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.02 -36.64 68.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.314 1.045 . . . . 0.0 113.518 -177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.5 -57.31 13.28 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.701 -0.625 . . . . 0.0 111.594 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . 0.501 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -57.98 -32.48 67.92 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.203 -0.936 . . . . 0.0 113.292 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -64.85 -25.37 67.87 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 173.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.9 mp -92.52 -35.58 13.52 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.744 1.218 . . . . 0.0 111.829 177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.88 103.27 2.66 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 124.194 0.998 . . . . 0.0 111.732 174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.69 16.98 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 124.21 3.274 . . . . 0.0 113.371 175.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -110.02 -33.68 6.63 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.571 1.948 . . . . 0.0 113.042 -172.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.6 t90 -89.91 -45.84 8.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 171.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' ' 515' ' ' ALA . 7.1 tt -120.09 132.57 55.48 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.904 1.282 . . . . 0.0 110.714 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 58.8 m -130.02 125.95 36.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.782 1.233 . . . . 0.0 111.906 174.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . 0.456 HD11 ' HA ' ' A' ' 512' ' ' VAL . 8.7 mt -82.5 130.11 35.05 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 169.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -134.09 114.64 13.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 123.121 1.439 . . . . 0.0 113.206 -175.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -81.96 128.27 33.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.466 1.106 . . . . 0.0 110.262 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.8 tp -87.19 -164.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.19 0 C-N-CA 124.263 1.025 . . . . 0.0 110.263 173.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.0 mmp_? -43.91 -46.32 8.02 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 40.7 p -145.63 -22.68 0.47 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -93.07 174.86 7.01 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.804 1.642 . . . . 0.0 113.144 173.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 5.8 m -121.59 125.1 45.94 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.521 1.128 . . . . 0.0 110.865 172.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -107.29 145.36 32.86 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.47 169.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 41.1 t -112.62 141.22 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 O-C-N 120.977 -1.077 . . . . 0.0 110.356 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -121.73 127.41 50.66 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.826 1.65 . . . . 0.0 111.214 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.16 152.3 50.58 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.624 1.97 . . . . 0.0 112.967 172.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.53 108.42 19.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.606 0.762 . . . . 0.0 110.86 173.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.57 -15.89 62.81 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 176.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.49 -4.17 59.13 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.196 1.398 . . . . 0.0 113.529 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.9 p -68.43 154.94 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.808 0.843 . . . . 0.0 111.513 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -76.27 117.24 17.75 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.662 -0.649 . . . . 0.0 110.373 171.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -55.16 -49.99 70.43 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.255 0.622 . . . . 0.0 111.14 178.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.35 -21.55 25.26 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.697 1.199 . . . . 0.0 114.222 175.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.43 -41.51 11.42 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.266 0.936 . . . . 0.0 112.946 172.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.652 1.181 . . . . 0.0 112.881 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.1 t -62.93 -19.48 64.28 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.15 -0.969 . . . . 0.0 112.945 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.19 -39.68 59.98 Favored 'General case' 0 CA--C 1.549 0.914 0 O-C-N 120.229 -1.544 . . . . 0.0 113.542 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -86.21 -39.73 16.31 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -21.66 62.74 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 121.004 -1.06 . . . . 0.0 112.563 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -54.01 -23.39 13.21 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.523 1.129 . . . . 0.0 113.694 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -55.58 -30.83 61.52 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 46.5 t60 -81.38 -41.82 21.39 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.69 0.796 . . . . 0.0 113.105 171.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.94 -25.23 35.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.123 -0.986 . . . . 0.0 113.174 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -51.68 -17.24 0.82 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 114.749 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.43 -41.46 39.97 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.656 1.582 . . . . 0.0 114.143 169.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -109.27 -20.49 12.93 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.854 1.262 . . . . 0.0 114.079 171.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 87.2 62.48 1.49 Allowed Glycine 0 CA--C 1.54 1.607 0 N-CA-C 116.622 1.409 . . . . 0.0 116.622 169.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.56 1.356 0 C-N-CA 128.292 2.637 . . . . 0.0 116.187 -175.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 CA-C-O 118.343 -1.254 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.95 -71.89 0.02 OUTLIER 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.384 3.39 . . . . 0.0 115.085 -170.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 5.1 mp 34.49 51.88 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 128.451 2.7 . . . . 0.0 115.051 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 154.58 -18.56 0.59 Allowed Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.994 1.283 . . . . 0.0 115.471 -175.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 35.1 m -128.77 -0.46 5.4 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -169.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.21 72.55 8.25 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 120.868 -1.145 . . . . 0.0 113.188 -177.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 10.1 t -57.67 154.8 10.96 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.954 -1.091 . . . . 0.0 112.685 170.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 50.98 50.12 19.77 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 177.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.13 131.4 15.42 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -73.44 2.22 5.95 Favored 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.361 3.374 . . . . 0.0 114.737 177.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.92 -20.16 33.45 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 119.637 1.108 . . . . 0.0 113.271 169.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -34.46 67.99 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.094 0.558 . . . . 0.0 111.619 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -75.61 -42.97 50.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -59.07 -17.63 27.68 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.459 1.104 . . . . 0.0 113.226 179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.73 -44.23 21.16 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.436 0.694 . . . . 0.0 112.046 174.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.49 -29.62 27.82 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.343 1.057 . . . . 0.0 113.656 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -59.76 -55.49 33.59 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.337 0.971 . . . . 0.0 110.073 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -54.71 -35.54 63.75 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.879 -1.138 . . . . 0.0 113.586 174.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.47 HD23 ' C ' ' A' ' 463' ' ' LEU . 0.2 OUTLIER -65.04 -31.25 72.39 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.408 ' N ' HD23 ' A' ' 463' ' ' LEU . 6.7 pt-20 -85.62 -24.97 26.91 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 120.69 1.586 . . . . 0.0 112.758 173.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.477 HH12 HG21 ' A' ' 500' ' ' THR . 27.3 mmt180 -75.31 -45.99 36.18 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 124.39 1.076 . . . . 0.0 110.922 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 548' ' ' LEU . 38.4 mt -46.44 -55.33 14.37 Favored Pre-proline 0 CA--C 1.564 1.516 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 171.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.38 -39.23 2.96 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 125.006 3.804 . . . . 0.0 113.523 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -63.17 -51.78 65.01 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 118.736 0.698 . . . . 0.0 111.807 173.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.603 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.0 mm? -56.89 -29.27 62.83 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.448 -0.783 . . . . 0.0 112.131 176.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -61.09 -36.49 79.82 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.265 -0.897 . . . . 0.0 113.104 176.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -29.33 24.11 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.495 -0.753 . . . . 0.0 112.646 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.603 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -84.95 -27.16 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.918 -1.039 . . . . 0.0 112.094 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.71 -35.78 66.47 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.642 1.565 . . . . 0.0 112.312 174.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.09 -43.19 99.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.06 1.344 . . . . 0.0 111.615 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -35.39 72.08 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.213 0.605 . . . . 0.0 111.667 178.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.676 HG13 ' HB3' ' A' ' 493' ' ' ARG . 76.9 t -70.2 -36.18 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.771 1.229 . . . . 0.0 112.136 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -58.7 -51.44 69.96 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.98 0.912 . . . . 0.0 111.741 169.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 12.5 p -78.14 -34.26 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.182 0.593 . . . . 0.0 111.897 -170.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.2 m -60.32 -31.76 70.58 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.383 -0.823 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -91.02 -8.06 50.16 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 172.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 58.22 23.87 10.79 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.641 1.977 . . . . 0.0 115.24 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -148.55 149.22 30.69 Favored Pre-proline 0 N--CA 1.477 0.915 0 CA-C-N 120.284 1.402 . . . . 0.0 114.336 -174.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.17 -16.88 22.25 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 124.118 3.212 . . . . 0.0 115.289 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -123.55 124.72 43.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.431 1.092 . . . . 0.0 109.891 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.9 mt -129.43 129.1 44.24 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.698 1.199 . . . . 0.0 109.469 -170.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.93 155.0 29.2 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -48.07 -29.04 3.21 Favored 'General case' 0 CA--C 1.548 0.865 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 169.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -69.85 -37.34 76.1 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.32 1.048 . . . . 0.0 112.741 178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.5 -56.52 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 123.147 0.579 . . . . 0.0 109.983 169.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.9 t -62.78 -39.29 84.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.99 -29.12 63.01 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 172.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.81 -47.19 9.95 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.868 -1.145 . . . . 0.0 113.347 169.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.676 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.5 OUTLIER -73.95 -44.86 53.52 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.498 1.119 . . . . 0.0 112.77 -169.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -20.9 63.22 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 120.672 -1.267 . . . . 0.0 112.792 173.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 45.1 t -85.94 -51.12 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.496 1.118 . . . . 0.0 112.026 175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -92.46 -34.69 14.01 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -173.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.3 t -75.92 -39.95 55.2 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.868 0.758 . . . . 0.0 112.353 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.56 ' SG ' HG11 ' A' ' 472' ' ' VAL . 43.3 t -65.29 148.54 51.51 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 120.939 -1.101 . . . . 0.0 112.227 169.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -60.17 -30.1 69.11 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 170.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.477 HG21 HH12 ' A' ' 465' ' ' ARG . 3.0 m -105.94 116.73 32.43 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.966 1.306 . . . . 0.0 111.334 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -75.15 128.57 35.8 Favored 'General case' 0 CA--C 1.549 0.926 0 O-C-N 121.089 -1.007 . . . . 0.0 110.919 172.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 28.6 tp -110.51 154.24 23.95 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.669 1.588 . . . . 0.0 112.679 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 25.7 m -69.45 145.75 95.74 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 124.166 0.986 . . . . 0.0 112.576 170.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.05 -20.88 43.76 Favored 'Trans proline' 0 CA--C 1.538 0.675 0 C-N-CA 123.532 2.822 . . . . 0.0 114.43 -177.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.99 -46.17 75.82 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 121.611 -0.681 . . . . 0.0 113.661 176.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -74.4 -36.49 63.49 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.44 1.096 . . . . 0.0 113.177 175.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -46.13 -53.98 9.44 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.531 1.133 . . . . 0.0 112.944 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.29 -45.36 91.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.345 0.658 . . . . 0.0 112.019 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -61.16 -30.1 70.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.609 1.164 . . . . 0.0 113.667 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.72 -36.93 31.47 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.7 mt -62.14 -40.98 97.76 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.63 -0.669 . . . . 0.0 112.191 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -71.75 -37.1 61.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.061 0.544 . . . . 0.0 112.154 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.04 -42.36 69.11 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.73 -58.32 8.96 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.959 -0.463 . . . . 0.0 110.994 178.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.06 -32.47 66.27 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.16 1.171 . . . . 0.0 114.16 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.92 -29.38 69.79 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.083 1.353 . . . . 0.0 113.446 174.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.3 mp -93.63 -33.65 13.6 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.643 1.177 . . . . 0.0 111.73 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -153.97 105.98 2.47 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.094 1.358 . . . . 0.0 111.267 171.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -70.18 4.87 2.11 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.178 2.585 . . . . 0.0 113.091 172.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -83.57 -44.0 15.09 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.732 2.013 . . . . 0.0 112.961 -174.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -88.93 -44.77 10.2 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 10.2 tt -124.64 133.19 53.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.551 1.54 . . . . 0.0 109.447 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 9.7 m -129.66 126.63 38.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.776 1.23 . . . . 0.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 11.0 mt -82.19 135.3 35.29 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.12 152.59 51.94 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.524 1.53 . . . . 0.0 110.81 -175.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -123.59 118.78 28.1 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.1 -1.0 . . . . 0.0 110.194 -172.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.9 tp -85.19 -171.98 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 C-N-CA 124.375 1.07 . . . . 0.0 110.749 176.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -36.0 -47.84 0.56 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 127.242 2.217 . . . . 0.0 115.819 173.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 15.7 p -142.97 -7.75 0.82 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 125.518 1.527 . . . . 0.0 114.751 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -130.81 174.74 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.405 1.882 . . . . 0.0 112.727 -169.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 1.8 m -121.58 108.55 13.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.239 1.015 . . . . 0.0 111.041 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -101.86 133.09 47.17 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.703 0.801 . . . . 0.0 111.61 175.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 7.5 p -100.36 143.48 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.502 1.121 . . . . 0.0 110.844 176.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -125.81 127.04 45.49 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.614 1.165 . . . . 0.0 111.47 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.15 152.45 50.43 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.993 1.717 . . . . 0.0 113.208 177.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -88.13 108.4 19.24 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 121.49 -0.756 . . . . 0.0 110.852 170.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -15.9 61.83 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.19 -1.85 57.98 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.991 1.716 . . . . 0.0 113.884 -174.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.42 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.7 p -61.02 154.84 4.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 125.416 1.487 . . . . 0.0 112.392 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -80.35 111.96 17.23 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.455 -0.778 . . . . 0.0 110.548 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -49.82 -48.92 50.57 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.25 1.02 . . . . 0.0 111.907 -173.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.88 -23.83 20.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.728 1.211 . . . . 0.0 114.126 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.95 -48.49 54.0 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.0 0.809 . . . . 0.0 113.321 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.54 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -64.87 -57.91 7.57 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.605 1.202 . . . . 0.0 111.11 -175.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 5.8 t -58.09 -18.99 28.73 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 175.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -83.97 -40.75 18.09 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 169.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -84.72 -34.27 22.95 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 121.026 -1.046 . . . . 0.0 113.718 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.465 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -71.61 -18.86 62.19 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.761 1.624 . . . . 0.0 111.485 172.438 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.61 -23.19 0.11 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.605 1.962 . . . . 0.0 115.919 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -47.23 -35.74 8.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.291 1.036 . . . . 0.0 113.691 169.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.53 -38.16 24.18 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 172.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 95.3 t -57.29 -30.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 124.226 1.011 . . . . 0.0 112.189 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -58.82 -17.18 21.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.56 1.544 . . . . 0.0 114.848 172.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.44 -34.13 66.53 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 120.96 -1.088 . . . . 0.0 113.832 174.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -109.43 -23.84 11.33 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.912 1.285 . . . . 0.0 112.722 169.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.69 72.76 1.17 Allowed Glycine 0 CA--C 1.536 1.372 0 C-N-CA 124.202 0.906 . . . . 0.0 114.615 170.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 4.5 mt . . . . . 0 C--O 1.254 1.29 0 C-N-CA 125.772 1.629 . . . . 0.0 113.929 179.668 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 CA-C-O 119.058 -0.857 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -73.67 -1.24 10.46 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 123.96 3.106 . . . . 0.0 117.05 -171.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.299 1.0 OUTLIER 54.18 -174.57 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 126.377 1.871 . . . . 0.0 114.275 -169.4 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -54.7 118.2 9.31 Favored Glycine 0 CA--C 1.54 1.612 0 O-C-N 120.848 -1.158 . . . . 0.0 113.782 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 t 65.68 97.93 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.686 1.995 . . . . 0.0 114.482 -173.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.83 166.89 12.42 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.506 1.922 . . . . 0.0 113.175 178.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 42.3 m -143.43 119.69 10.85 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.873 -1.142 . . . . 0.0 112.481 -175.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? 54.53 -165.96 0.09 Allowed 'General case' 0 CA--C 1.556 1.21 0 O-C-N 120.879 -1.138 . . . . 0.0 112.849 -172.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.8 t -56.71 130.99 78.13 Favored Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 120.636 -1.29 . . . . 0.0 112.141 174.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -65.48 -18.06 58.87 Favored 'Trans proline' 0 C--N 1.354 0.816 0 C-N-CA 123.509 2.806 . . . . 0.0 115.03 -172.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.79 -32.52 69.39 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 170.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.73 -34.52 77.02 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.479 0.581 . . . . 0.0 112.249 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -49.53 8.87 Favored 'General case' 0 CA--C 1.501 -0.93 0 CA-C-O 117.603 -1.189 . . . . 0.0 111.589 177.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.3 pp -58.03 -24.78 59.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 119.41 1.004 . . . . 0.0 112.634 -170.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -77.86 -37.14 48.92 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.228 1.411 . . . . 0.0 113.009 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.92 -34.23 26.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.639 0.776 . . . . 0.0 112.125 176.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -59.68 -51.82 68.17 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.269 -0.894 . . . . 0.0 110.028 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -57.76 -37.09 73.03 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.222 -0.924 . . . . 0.0 112.88 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.14 -36.38 81.62 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 178.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -86.12 -35.07 20.41 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.557 1.071 . . . . 0.0 112.641 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 2.2 mmt85 -68.73 -49.29 60.07 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 124.349 1.06 . . . . 0.0 111.851 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.48 ' HB3' HD21 ' A' ' 548' ' ' LEU . 77.8 mt -50.23 -50.44 70.3 Favored Pre-proline 0 CA--C 1.563 1.454 0 CA-C-N 120.245 1.384 . . . . 0.0 114.672 176.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -75.37 -38.66 1.35 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.241 3.294 . . . . 0.0 114.002 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -56.46 -54.33 46.94 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.187 0.995 . . . . 0.0 110.805 171.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.672 ' HA ' HG22 ' A' ' 472' ' ' VAL . 0.8 OUTLIER -58.4 -29.51 66.11 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 177.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.62 -29.71 70.91 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.369 -0.832 . . . . 0.0 112.58 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -34.84 21.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.59 -0.693 . . . . 0.0 112.042 174.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.0 m -80.12 -28.48 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.75 -36.78 65.18 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.254 0.934 . . . . 0.0 111.51 176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -45.85 89.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.229 1.012 . . . . 0.0 111.186 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . 0.424 HD22 ' HA ' ' A' ' 472' ' ' VAL . 0.1 OUTLIER -68.29 -36.41 79.32 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.4 t -66.15 -42.33 91.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 O-C-N 121.45 -0.781 . . . . 0.0 111.851 178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.423 ' HA ' HD11 ' A' ' 485' ' ' LEU . 8.5 m-85 -67.1 -43.88 81.4 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.34 -33.29 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 O-C-N 121.241 -0.912 . . . . 0.0 113.43 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 70.3 m -65.23 -25.29 67.62 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.356 1.435 . . . . 0.0 113.441 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -90.52 -13.83 33.87 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.686 1.194 . . . . 0.0 113.48 169.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 56.72 42.14 27.25 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.573 1.949 . . . . 0.0 113.882 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -135.14 146.38 58.05 Favored Pre-proline 0 CA--C 1.549 0.938 0 O-C-N 121.07 -1.019 . . . . 0.0 112.112 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.06 -18.23 18.77 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.889 3.059 . . . . 0.0 113.719 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.29 129.34 22.01 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.107 1.763 . . . . 0.0 109.623 -177.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.7 mt -119.22 133.32 55.83 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.659 1.184 . . . . 0.0 110.727 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.04 156.46 31.78 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -28.42 2.57 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 169.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -66.63 -40.03 88.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.821 1.249 . . . . 0.0 112.733 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 31.8 t -71.26 -53.27 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 122.991 0.516 . . . . 0.0 110.53 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.17 -40.85 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.103 -170.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 15.5 t -60.47 -24.15 65.04 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.02 -50.56 6.96 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.68 -1.262 . . . . 0.0 112.663 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.689 ' HB3' HG13 ' A' ' 476' ' ' VAL . 5.7 mpt_? -74.75 -44.32 50.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.322 1.049 . . . . 0.0 112.974 -169.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.473 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -58.65 -20.5 48.43 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 172.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 42.0 t -83.62 -57.33 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.355 1.062 . . . . 0.0 111.512 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -92.95 -34.69 13.66 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -169.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 1.5 t -73.21 -32.84 65.01 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.065 0.546 . . . . 0.0 112.175 175.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 16.6 m -77.68 152.8 33.59 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.286 -0.884 . . . . 0.0 112.885 173.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -63.03 -30.25 71.45 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 176.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 56.9 m -106.32 136.61 45.75 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.265 1.426 . . . . 0.0 111.966 171.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -93.63 130.76 39.44 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.735 1.214 . . . . 0.0 110.258 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 18.2 tp -119.83 153.32 35.95 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.39 1.876 . . . . 0.0 111.488 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 66.4 m -71.21 149.59 94.34 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 124.374 1.069 . . . . 0.0 113.833 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.51 -23.81 36.88 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.048 3.166 . . . . 0.0 114.844 -176.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -70.02 -36.69 72.99 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 121.588 -0.695 . . . . 0.0 113.421 174.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -83.55 -32.38 25.88 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 125.134 1.373 . . . . 0.0 112.808 175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 1.9 ttp -46.55 -50.62 16.99 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.431 1.092 . . . . 0.0 112.083 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.11 -48.46 81.53 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.411 0.684 . . . . 0.0 111.928 -178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.7 mmpt? -63.42 -29.95 71.16 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.583 1.553 . . . . 0.0 113.38 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -81.93 -41.68 20.52 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.303 1.441 . . . . 0.0 112.926 178.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 67.5 mt -61.32 -48.08 83.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.435 0.694 . . . . 0.0 111.325 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.82 -37.6 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 119.388 -0.339 . . . . 0.0 111.423 176.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.48 -51.28 56.36 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.879 0.871 . . . . 0.0 113.078 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.1 mt -51.25 -57.4 8.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 123.743 0.817 . . . . 0.0 112.289 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -61.07 -25.56 67.03 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 175.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.55 -20.29 62.81 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.588 1.555 . . . . 0.0 113.334 174.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 63.2 mt -101.64 -33.12 10.02 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.596 1.158 . . . . 0.0 112.172 177.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -147.52 100.52 3.79 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.2 1.0 . . . . 0.0 112.131 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -71.83 12.39 0.57 Allowed 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.639 2.893 . . . . 0.0 113.491 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.98 -29.6 14.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.227 1.811 . . . . 0.0 113.543 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -106.3 -50.25 3.19 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.881 0.872 . . . . 0.0 113.012 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.8 tp -104.58 137.16 42.84 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.016 0.926 . . . . 0.0 109.488 169.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 70.0 m -129.6 125.43 36.16 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.922 0.889 . . . . 0.0 110.995 169.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -82.72 113.48 20.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.779 1.232 . . . . 0.0 107.862 169.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -112.77 152.77 28.74 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.726 1.21 . . . . 0.0 111.432 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.9 tpp85 -125.9 124.01 39.88 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.899 -1.126 . . . . 0.0 110.051 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.45 -167.59 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 123.991 0.917 . . . . 0.0 110.331 173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 76.0 mtt-85 -42.31 -46.89 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.775 1.63 . . . . 0.0 115.336 174.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 17.7 p -141.48 -12.6 0.9 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.667 1.587 . . . . 0.0 114.524 -173.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -124.5 170.39 10.93 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.733 2.013 . . . . 0.0 111.8 -170.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.1 m -121.73 104.96 9.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.355 1.062 . . . . 0.0 110.921 -173.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -99.07 145.44 27.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.449 0.643 . . . . 0.0 110.926 171.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.1 t -115.2 144.16 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 O-C-N 120.903 -1.123 . . . . 0.0 109.028 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -122.51 126.57 48.11 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.733 0.813 . . . . 0.0 110.934 178.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -134.6 134.09 40.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.378 1.871 . . . . 0.0 111.001 -175.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -84.16 106.73 16.02 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.585 1.084 . . . . 0.0 110.687 175.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -11.9 60.87 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.691 1.597 . . . . 0.0 113.857 172.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.32 -8.4 58.5 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.007 1.323 . . . . 0.0 114.005 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 4.3 p -64.63 155.27 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 125.591 1.556 . . . . 0.0 113.184 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -85.5 119.0 25.37 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.581 -0.699 . . . . 0.0 110.165 169.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -48.98 -47.51 44.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.376 1.071 . . . . 0.0 111.774 -178.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.06 -21.64 13.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -76.42 -46.54 12.02 Favored Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.421 -0.799 . . . . 0.0 113.828 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.724 ' H ' HD22 ' A' ' 544' ' ' LEU . 1.8 mm? -61.71 -56.62 17.74 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.885 1.342 . . . . 0.0 111.597 177.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.24 -22.91 54.16 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 121.465 -0.772 . . . . 0.0 112.675 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.77 -45.6 61.13 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.618 -1.301 . . . . 0.0 113.813 170.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -86.56 -38.94 16.68 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.656 1.724 . . . . 0.0 115.656 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -64.48 -26.36 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.349 1.46 . . . . 0.0 111.998 172.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -52.69 -23.54 6.86 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -48.32 -33.28 8.64 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 170.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -82.64 -44.76 15.37 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -64.03 -23.5 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.154 -0.966 . . . . 0.0 112.94 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -51.04 -16.7 0.49 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.232 1.813 . . . . 0.0 114.951 169.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -49.57 -35.34 20.28 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.272 1.029 . . . . 0.0 113.318 169.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -109.26 -23.38 11.63 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.361 1.464 . . . . 0.0 113.786 169.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 104.96 27.41 5.95 Favored Glycine 0 N--CA 1.478 1.442 0 N-CA-C 116.492 1.357 . . . . 0.0 116.492 169.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 11.1 tp . . . . . 0 N--CA 1.485 1.278 0 C-N-CA 129.315 3.046 . . . . 0.0 112.546 179.599 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.776 0 CA-C-O 118.836 -0.98 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.5 23.63 0.78 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.975 3.783 . . . . 0.0 115.578 -170.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 45.56 26.68 0.34 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 171.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.93 3.67 59.08 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.334 1.445 . . . . 0.0 116.451 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 64.2 p -104.5 -2.89 24.64 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.755 1.778 . . . . 0.0 115.617 -174.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -148.7 138.03 21.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.751 1.62 . . . . 0.0 111.761 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.5 m -151.49 151.56 31.79 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.94 1.696 . . . . 0.0 110.226 174.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.74 168.63 14.58 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 120.965 -1.084 . . . . 0.0 113.792 170.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.8 m 64.51 155.64 0.12 Allowed Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.075 2.55 . . . . 0.0 116.329 178.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.97 -19.39 39.98 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.327 2.685 . . . . 0.0 113.993 178.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -54.91 -35.79 64.53 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 176.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.46 -31.88 70.45 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -86.82 -49.52 7.37 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.02 -17.71 40.87 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.668 1.122 . . . . 0.0 113.662 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -83.53 -38.18 22.05 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.825 1.25 . . . . 0.0 112.866 174.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.38 -32.27 29.3 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.442 -0.786 . . . . 0.0 111.906 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -61.91 -45.81 92.12 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 120.923 -1.11 . . . . 0.0 110.528 175.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -61.68 -38.74 88.92 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.668 -1.27 . . . . 0.0 112.681 172.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.54 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -62.98 -35.67 80.95 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 179.013 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.54 ' N ' HD23 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -85.83 -25.51 26.24 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.768 1.167 . . . . 0.0 112.87 177.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -80.17 -44.88 19.08 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 124.452 1.101 . . . . 0.0 111.955 177.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 26.7 mt -45.19 -51.84 23.11 Favored Pre-proline 0 CA--C 1.564 1.488 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 173.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -74.0 -41.04 1.1 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.96 3.773 . . . . 0.0 113.384 176.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.39 -53.66 45.03 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.74 0.816 . . . . 0.0 112.464 176.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.535 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -51.95 -33.13 36.25 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.802 0.841 . . . . 0.0 111.494 174.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.65 74.1 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.55 -30.08 23.66 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.044 -1.035 . . . . 0.0 113.217 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.535 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -83.04 -22.98 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 175.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.46 -36.05 73.11 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.832 -1.167 . . . . 0.0 113.592 177.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.69 -44.02 90.16 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.808 0.843 . . . . 0.0 110.598 171.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -66.56 -38.87 88.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.722 0.809 . . . . 0.0 111.836 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.677 HG13 ' HB3' ' A' ' 493' ' ' ARG . 61.3 t -64.6 -42.76 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 O-C-N 121.031 -1.043 . . . . 0.0 112.173 175.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.401 ' HA ' HD11 ' A' ' 485' ' ' LEU . 0.3 OUTLIER -64.08 -45.34 89.18 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.365 -0.835 . . . . 0.0 113.149 179.289 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.9 p -75.7 -33.12 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.844 1.258 . . . . 0.0 113.469 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 31.8 t -58.83 -32.23 69.2 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.821 -1.174 . . . . 0.0 112.897 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 26.0 tp10 -90.34 -12.34 37.98 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 174.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 51.15 44.39 28.73 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.875 1.67 . . . . 0.0 113.344 -175.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 20.9 mtpp -134.0 143.78 48.8 Favored Pre-proline 0 N--CA 1.477 0.924 0 O-C-N 121.338 -0.851 . . . . 0.0 112.826 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -79.12 -11.44 14.82 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 124.49 3.46 . . . . 0.0 114.295 -177.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.12 137.38 30.89 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.838 2.055 . . . . 0.0 109.102 170.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 477' ' ' PHE . 31.3 mt -116.49 131.95 56.81 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.709 0.803 . . . . 0.0 110.344 177.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -76.01 152.33 36.98 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 173.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -45.48 -27.82 0.8 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 170.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.4 -43.72 85.04 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.722 1.209 . . . . 0.0 111.982 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.57 -54.27 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.517 0.727 . . . . 0.0 110.804 172.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.8 t -60.91 -43.2 95.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-N 117.98 0.354 . . . . 0.0 110.467 -169.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 53.2 t -52.01 -42.46 63.02 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.532 1.133 . . . . 0.0 113.473 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -81.54 -51.6 8.09 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.576 1.15 . . . . 0.0 113.488 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.677 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -62.0 -40.55 96.04 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 123.319 0.648 . . . . 0.0 110.824 -177.266 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.449 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.51 -20.71 61.06 Favored 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 172.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 2.5 t -80.56 -51.93 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 O-C-N 120.442 -1.411 . . . . 0.0 111.598 169.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -92.77 -39.71 11.08 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 4.5 t -71.96 -34.25 68.82 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 26.3 m -75.13 148.17 39.9 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.241 -0.912 . . . . 0.0 112.175 172.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -62.06 -31.82 72.29 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -106.19 116.86 32.66 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.032 1.333 . . . . 0.0 111.661 175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.88 130.98 43.05 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.847 0.859 . . . . 0.0 110.57 169.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 65.4 tp -121.57 157.29 31.05 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.341 1.857 . . . . 0.0 112.045 174.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 46.2 m -70.44 147.58 95.03 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.735 1.214 . . . . 0.0 113.097 176.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.24 -28.57 40.02 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.41 2.74 . . . . 0.0 113.682 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.28 -41.57 78.48 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 123.706 0.669 . . . . 0.0 114.416 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -75.55 -44.0 45.74 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 117.803 0.801 . . . . 0.0 111.876 173.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -30.91 71.94 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.005 -0.522 . . . . 0.0 112.339 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -60.02 -46.11 90.59 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.385 0.993 . . . . 0.0 111.975 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -66.88 -29.71 69.68 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.802 1.641 . . . . 0.0 112.521 172.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -79.3 -42.77 25.02 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 25.0 mt -56.52 -38.93 72.49 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.839 1.256 . . . . 0.0 112.236 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.3 p -76.11 -34.29 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.466 0.707 . . . . 0.0 112.731 174.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -40.38 75.81 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.756 -0.59 . . . . 0.0 112.426 175.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.53 -52.64 64.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.67 -29.0 64.27 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -67.02 -28.4 68.2 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.45 -38.34 59.77 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.784 0.72 . . . . 0.0 112.718 172.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -154.21 105.2 2.42 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 124.302 1.041 . . . . 0.0 111.337 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.89 16.03 0.36 Allowed 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.333 3.355 . . . . 0.0 113.851 177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -115.27 -30.89 6.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.603 1.961 . . . . 0.0 114.039 -170.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.5 t90 -98.22 -48.7 4.98 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 177.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.8 tt -111.42 125.2 53.63 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.678 1.191 . . . . 0.0 108.822 170.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 35.4 m -129.78 125.66 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.635 0.774 . . . . 0.0 109.714 175.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 12.4 mt -82.51 135.89 35.0 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 169.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -129.16 152.79 48.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.167 1.787 . . . . 0.0 111.504 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.44 122.68 34.15 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.501 -1.375 . . . . 0.0 109.526 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 528' ' ' ARG . 2.6 tp -84.33 -158.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 124.212 1.005 . . . . 0.0 109.902 -176.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . 0.4 ' N ' HG23 ' A' ' 527' ' ' ILE . 31.3 mtp180 -47.43 -44.44 24.75 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.2 -1.562 . . . . 0.0 114.596 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.7 p -148.98 -22.98 0.3 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -86.51 171.46 11.07 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 125.968 1.707 . . . . 0.0 113.355 173.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.5 m -125.2 113.89 18.26 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.999 1.32 . . . . 0.0 110.842 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -105.62 151.86 23.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 122.004 0.906 . . . . 0.0 113.155 174.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 44.3 t -117.03 142.35 31.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 O-C-N 120.819 -1.176 . . . . 0.0 109.12 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -118.6 126.56 52.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.605 0.762 . . . . 0.0 109.863 175.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.15 127.7 30.68 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.571 1.548 . . . . 0.0 110.383 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -81.57 105.76 12.98 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.306 0.957 . . . . 0.0 109.587 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.44 -11.42 60.03 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.945 1.298 . . . . 0.0 113.282 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.0 -5.32 53.22 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.683 1.593 . . . . 0.0 114.307 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.581 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.4 p -67.18 154.91 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.327 1.051 . . . . 0.0 112.412 176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -74.43 120.26 19.76 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.613 -0.679 . . . . 0.0 110.46 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.59 -46.15 66.82 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.28 0.632 . . . . 0.0 112.064 -177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.99 -21.69 22.6 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 178.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.53 -43.33 53.25 Favored Glycine 0 CA--C 1.534 1.252 0 O-C-N 121.364 -0.835 . . . . 0.0 114.091 173.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.581 HD21 ' CG1' ' A' ' 539' ' ' VAL . 0.9 OUTLIER -69.29 -55.97 8.93 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 118.955 1.377 . . . . 0.0 112.09 179.564 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.4 t -60.62 -22.45 63.8 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.417 -0.802 . . . . 0.0 112.272 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.04 68.25 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 170.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.7 ptm85 -86.38 -36.87 18.92 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.54 -18.85 64.44 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.762 1.625 . . . . 0.0 112.982 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.12 -23.22 0.15 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.12 1.768 . . . . 0.0 115.063 171.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -49.23 -35.04 16.33 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.234 1.013 . . . . 0.0 113.347 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.27 -36.96 26.57 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.834 1.049 . . . . 0.0 113.834 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.33 -29.99 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.791 1.237 . . . . 0.0 111.762 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -56.08 -17.08 6.05 Favored 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 170.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.46 -33.06 69.34 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.654 1.182 . . . . 0.0 113.68 171.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -109.08 -23.5 11.63 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 125.283 1.433 . . . . 0.0 112.879 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 88.42 51.78 3.03 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.491 1.044 . . . . 0.0 114.355 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 33.8 mt . . . . . 0 C--O 1.251 1.184 0 C-N-CA 126.329 1.852 . . . . 0.0 113.028 -173.467 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 118.607 -1.107 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -81.38 34.68 0.56 Allowed 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 125.076 3.851 . . . . 0.0 114.501 -172.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 71.72 -27.65 0.18 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 127.109 2.163 . . . . 0.0 116.052 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -179.16 49.06 0.09 OUTLIER Glycine 0 CA--C 1.535 1.341 0 C-N-CA 126.132 1.825 . . . . 0.0 112.953 -171.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 86.4 p 49.21 31.56 3.7 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 126.9 2.08 . . . . 0.0 116.134 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.94 91.15 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.758 1.223 . . . . 0.0 114.068 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 12.0 m -148.72 147.57 29.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.527 1.931 . . . . 0.0 109.537 -175.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 38.6 44.63 0.8 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.689 1.995 . . . . 0.0 115.87 173.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 18.1 p -55.75 117.69 16.58 Favored Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.175 1.39 . . . . 0.0 114.455 -169.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -66.89 -23.65 47.23 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.87 2.38 . . . . 0.0 113.686 -176.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -59.15 -30.54 68.23 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.83 -31.33 63.17 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 118.64 0.655 . . . . 0.0 112.45 176.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -86.66 -49.23 7.65 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 118.012 -0.994 . . . . 0.0 113.669 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -59.94 -18.37 44.74 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.892 1.223 . . . . 0.0 113.537 -176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.3 ptm85 -79.95 -39.91 29.2 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.303 1.041 . . . . 0.0 112.586 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.67 -32.54 28.08 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.728 -0.608 . . . . 0.0 111.491 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -59.66 -53.69 55.07 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.364 -0.835 . . . . 0.0 109.801 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 -56.66 -36.46 69.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.576 1.08 . . . . 0.0 112.934 176.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.515 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -64.83 -36.78 85.43 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 178.118 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.515 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.8 -28.45 24.5 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 120.3 1.409 . . . . 0.0 112.769 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -72.9 -52.28 15.31 Favored 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 124.538 1.135 . . . . 0.0 111.476 177.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 32.6 mt -45.01 -52.51 19.19 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-N 120.631 1.56 . . . . 0.0 114.855 176.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -73.98 -40.58 1.28 Allowed 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.651 3.568 . . . . 0.0 113.915 177.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.65 -52.77 55.62 Favored 'General case' 0 N--CA 1.481 1.093 0 O-C-N 121.308 -0.87 . . . . 0.0 111.971 175.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.56 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.3 mm? -53.15 -33.57 53.08 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.498 -0.751 . . . . 0.0 111.601 173.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.62 -39.9 89.9 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.113 0.869 . . . . 0.0 112.872 174.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.04 -26.04 36.67 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.282 -0.886 . . . . 0.0 112.701 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.4 m -89.39 -22.59 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 175.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -42.85 87.41 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 120.521 1.509 . . . . 0.0 112.045 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -38.74 92.31 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.447 0.699 . . . . 0.0 111.254 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -68.07 -40.17 82.78 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.433 1.093 . . . . 0.0 111.989 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.674 HG13 ' HB3' ' A' ' 493' ' ' ARG . 47.1 t -61.55 -44.57 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 125.19 1.396 . . . . 0.0 111.166 173.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -46.23 89.41 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.956 0.902 . . . . 0.0 113.088 178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.3 p -78.06 -32.79 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.049 1.34 . . . . 0.0 113.877 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 29.1 m -63.28 -25.14 68.18 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.215 1.37 . . . . 0.0 113.302 174.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.4 tp10 -90.7 -19.99 22.96 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.32 1.448 . . . . 0.0 113.467 173.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 54.52 46.92 23.88 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.244 1.418 . . . . 0.0 113.24 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -133.93 148.09 66.8 Favored Pre-proline 0 N--CA 1.478 0.971 0 O-C-N 121.055 -1.028 . . . . 0.0 112.902 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.13 -14.11 12.28 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 124.423 3.415 . . . . 0.0 114.051 178.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.19 133.91 26.94 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.618 1.967 . . . . 0.0 109.192 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 11.2 mp -114.24 129.07 56.63 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.006 0.922 . . . . 0.0 109.407 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 156.27 31.82 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.594 0.758 . . . . 0.0 109.427 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -46.13 -28.27 1.18 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 169.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.7 -45.79 64.31 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.895 0.878 . . . . 0.0 112.219 176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.52 -52.07 55.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.233 0.613 . . . . 0.0 110.85 173.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 28.0 t -59.95 -40.72 83.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 118.311 0.505 . . . . 0.0 110.509 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 40.4 t -59.6 -27.69 66.52 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 175.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.07 -54.92 4.19 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.707 -1.246 . . . . 0.0 113.838 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.674 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.7 mpt_? -69.26 -41.45 76.87 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.96 0.904 . . . . 0.0 113.207 -169.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 469' ' ' LEU . 1.2 ppp? -57.18 -23.34 46.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.788 -1.195 . . . . 0.0 113.521 171.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 25.5 t -85.69 -47.63 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.414 1.086 . . . . 0.0 111.482 177.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.62 -38.78 12.9 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -175.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -70.63 -39.7 73.53 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.668 0.667 . . . . 0.0 112.595 173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.429 ' SG ' HG11 ' A' ' 472' ' ' VAL . 45.4 t -64.06 141.04 58.91 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.951 -1.093 . . . . 0.0 111.614 169.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -62.16 -29.18 70.17 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 173.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 93.2 m -106.21 116.67 32.34 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.525 1.53 . . . . 0.0 112.06 171.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -72.05 112.55 8.24 Favored 'General case' 0 CA--C 1.552 1.021 0 O-C-N 121.119 -0.988 . . . . 0.0 111.896 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.5 tp -96.2 152.05 18.92 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.045 1.338 . . . . 0.0 113.309 -179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 38.6 m -69.21 143.41 93.84 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.578 1.151 . . . . 0.0 113.15 173.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.15 -26.14 57.61 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.882 3.054 . . . . 0.0 114.63 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.24 -44.01 94.42 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 123.822 0.725 . . . . 0.0 114.037 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -81.5 -37.79 27.33 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.064 0.946 . . . . 0.0 112.681 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 6.3 ttm -48.05 -52.87 18.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.442 1.097 . . . . 0.0 112.267 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.63 -40.63 88.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.326 0.65 . . . . 0.0 112.408 -177.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -68.17 -32.01 71.96 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.254 1.822 . . . . 0.0 113.382 174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -77.93 -40.48 39.45 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.655 1.182 . . . . 0.0 113.475 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 78.3 mt -59.15 -43.32 92.04 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.621 0.768 . . . . 0.0 111.685 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.5 -37.07 68.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.441 0.696 . . . . 0.0 111.818 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -42.69 74.25 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.687 0.795 . . . . 0.0 112.859 175.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.33 -54.92 37.5 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.55 -31.32 69.31 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 173.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -32.06 72.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.895 1.278 . . . . 0.0 113.4 174.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 8.0 mp -80.69 -36.73 31.9 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.729 0.811 . . . . 0.0 112.336 176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -152.27 106.22 2.78 Favored Pre-proline 0 CA--C 1.554 1.132 0 C-N-CA 124.924 1.29 . . . . 0.0 110.98 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.94 3.89 2.59 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.417 2.745 . . . . 0.0 114.038 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -96.74 -42.08 8.17 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.629 1.572 . . . . 0.0 113.354 -173.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.459 ' CE2' HD21 ' A' ' 535' ' ' LEU . 26.2 t90 -84.77 -46.11 11.72 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.1 tt -117.1 131.3 56.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.07 1.348 . . . . 0.0 110.087 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.0 m -129.8 125.58 36.07 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.807 0.843 . . . . 0.0 111.957 177.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . 0.545 HD13 HG22 ' A' ' 533' ' ' VAL . 2.0 mm? -82.92 116.82 22.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.257 1.423 . . . . 0.0 109.332 170.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -122.93 152.96 40.33 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.069 1.748 . . . . 0.0 112.244 177.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.78 126.64 42.12 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.558 -1.339 . . . . 0.0 111.096 -175.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.1 tp -84.38 -159.32 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.209 0 C-N-CA 124.528 1.131 . . . . 0.0 110.19 -176.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.7 mmp_? -46.93 -46.14 21.14 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.079 -1.638 . . . . 0.0 114.7 171.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.2 p -147.48 -22.96 0.38 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.19 172.52 9.01 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.412 1.885 . . . . 0.0 112.964 172.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.3 m -121.79 124.92 45.33 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.319 1.448 . . . . 0.0 110.444 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -115.81 147.81 40.58 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.486 1.114 . . . . 0.0 113.355 174.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . 0.545 HG22 HD13 ' A' ' 524' ' ' LEU . 21.6 t -116.85 139.68 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.209 1.003 . . . . 0.0 109.114 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -115.17 126.73 54.93 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.872 0.869 . . . . 0.0 110.29 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.459 HD21 ' CE2' ' A' ' 521' ' ' TRP . 3.0 tm? -134.49 133.25 40.19 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.557 1.543 . . . . 0.0 111.363 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -84.33 108.06 16.97 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.471 1.032 . . . . 0.0 110.702 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -75.15 -11.06 60.0 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 178.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -92.36 -3.46 55.31 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.695 1.598 . . . . 0.0 114.223 -176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.415 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.5 p -63.44 155.27 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.518 1.527 . . . . 0.0 112.454 175.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -78.98 104.17 9.43 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.334 -0.854 . . . . 0.0 110.673 172.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -49.65 -46.37 49.58 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.491 1.116 . . . . 0.0 112.316 -170.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -54.08 -25.93 24.35 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.73 -40.46 89.99 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.844 1.212 . . . . 0.0 114.005 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.494 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -74.45 -56.34 4.96 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.275 1.43 . . . . 0.0 110.148 -173.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 4.5 t -56.6 -19.31 15.39 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.71 -41.79 20.8 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.987 1.267 . . . . 0.0 114.198 169.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -83.62 -36.16 24.09 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.69 -18.83 60.96 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.188 1.395 . . . . 0.0 112.504 176.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.64 -22.27 0.48 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.014 1.726 . . . . 0.0 115.361 170.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -48.4 -33.88 9.91 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 169.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -82.59 -35.51 27.02 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.2 t -56.84 -29.18 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 124.455 1.102 . . . . 0.0 112.144 172.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -17.13 3.83 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 115.386 1.625 . . . . 0.0 115.386 170.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.73 71.82 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.403 1.001 . . . . 0.0 113.688 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.74 -23.88 11.57 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.814 1.246 . . . . 0.0 113.148 169.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 94.58 55.94 1.39 Allowed Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.011 0.815 . . . . 0.0 114.718 169.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--O 1.252 1.201 0 C-N-CA 126.169 1.788 . . . . 0.0 112.559 -178.051 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 CA-C-O 118.581 -1.122 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -73.82 -178.81 4.04 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 124.242 3.294 . . . . 0.0 112.211 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -123.86 14.47 9.28 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -169.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 177.98 -60.51 0.09 OUTLIER Glycine 0 N--CA 1.474 1.232 0 O-C-N 121.389 -0.82 . . . . 0.0 114.088 169.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 66.1 m -149.52 111.88 4.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.185 1.394 . . . . 0.0 111.24 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 45.4 ttm -155.61 105.08 2.4 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.63 1.172 . . . . 0.0 111.345 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 8.8 t -63.31 133.28 53.88 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.312 -0.867 . . . . 0.0 112.487 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -152.76 -177.67 6.4 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 127.438 2.295 . . . . 0.0 110.83 172.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 92.6 m -45.27 157.31 0.35 Allowed Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 127.431 2.292 . . . . 0.0 115.618 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.34 -25.25 77.75 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 124.094 3.196 . . . . 0.0 114.779 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -59.4 -21.72 60.34 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 170.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -78.61 -40.39 34.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.008 0.822 . . . . 0.0 112.136 173.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -78.57 -39.86 36.42 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 117.946 -1.025 . . . . 0.0 112.562 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.2 pp -53.32 -22.11 6.72 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 38.3 mtp85 -74.37 -55.05 6.44 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.626 1.571 . . . . 0.0 110.543 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.1 pp -78.24 -29.21 48.04 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.261 0.624 . . . . 0.0 112.38 -176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -60.4 -52.45 65.17 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.273 -0.892 . . . . 0.0 110.174 171.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -53.17 -39.68 63.79 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.001 -1.062 . . . . 0.0 112.35 174.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -64.88 -33.63 76.47 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 178.479 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.429 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.7 pt-20 -86.2 -30.56 22.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 120.274 1.397 . . . . 0.0 112.946 176.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.47 -44.18 58.57 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.246 1.018 . . . . 0.0 111.586 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 13.2 mt -47.74 -55.98 15.07 Favored Pre-proline 0 CA--C 1.561 1.4 0 N-CA-C 114.92 1.452 . . . . 0.0 114.92 172.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.38 -39.28 2.93 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 124.84 3.693 . . . . 0.0 113.701 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -59.03 -56.81 17.45 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.892 0.877 . . . . 0.0 110.598 172.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.583 ' HA ' HG22 ' A' ' 472' ' ' VAL . 14.3 mt -56.66 -33.29 66.24 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.23 -40.85 91.64 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 118.523 0.602 . . . . 0.0 112.218 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . 0.499 ' HA ' HD21 ' A' ' 541' ' ' LEU . 6.8 ptm180 -79.77 -29.76 40.53 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.1 m -86.28 -22.77 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 121.527 -0.733 . . . . 0.0 112.034 -178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.52 -38.42 74.63 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.14 -0.975 . . . . 0.0 113.045 177.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -66.85 -34.04 76.93 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.709 -0.619 . . . . 0.0 111.605 175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -71.47 -34.0 69.81 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.241 1.017 . . . . 0.0 112.11 174.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.617 HG13 ' HB3' ' A' ' 493' ' ' ARG . 42.3 t -68.32 -42.45 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.806 1.243 . . . . 0.0 111.775 172.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -56.58 -51.65 67.8 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.36 1.464 . . . . 0.0 112.075 174.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.4 p -77.58 -29.54 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.229 1.011 . . . . 0.0 113.264 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 73.9 m -65.02 -29.04 69.92 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.468 -0.77 . . . . 0.0 112.927 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -90.76 -21.96 21.29 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.19 1.396 . . . . 0.0 113.224 174.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 23.8 mtp-105 62.56 38.64 12.25 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.986 1.714 . . . . 0.0 112.595 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -135.22 149.35 69.72 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.682 1.193 . . . . 0.0 111.282 -177.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.37 -26.27 20.7 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.112 2.541 . . . . 0.0 113.316 177.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -140.34 130.32 24.74 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.992 1.717 . . . . 0.0 110.282 -172.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.86 137.96 54.79 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.605 1.562 . . . . 0.0 109.657 -172.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.71 160.05 20.4 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.302 0.641 . . . . 0.0 109.956 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.85 -29.57 3.36 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 169.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.63 -41.53 83.74 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.815 0.846 . . . . 0.0 112.667 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.2 t -71.46 -54.39 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.169 0.588 . . . . 0.0 110.497 170.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.43 -41.27 86.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 118.573 -0.727 . . . . 0.0 111.481 -170.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 25.2 t -58.89 -24.58 62.45 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.8 -52.12 5.97 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.754 -1.216 . . . . 0.0 112.007 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.617 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.1 OUTLIER -68.87 -41.51 78.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.188 0.995 . . . . 0.0 112.865 -169.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.401 ' HG2' ' HG3' ' A' ' 507' ' ' MET . 0.1 OUTLIER -55.35 -21.63 16.02 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 120.391 -1.443 . . . . 0.0 114.418 169.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 14.6 t -86.23 -51.58 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.512 1.125 . . . . 0.0 112.195 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -92.56 -37.86 12.24 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 16.0 t -74.09 -40.2 62.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.124 0.874 . . . . 0.0 112.875 173.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.424 ' SG ' HG11 ' A' ' 472' ' ' VAL . 53.2 t -64.56 138.7 58.55 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.926 -1.109 . . . . 0.0 111.129 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -61.45 -29.66 70.1 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 177.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 53.0 m -106.15 116.77 32.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.763 1.625 . . . . 0.0 111.33 172.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -65.54 105.32 1.17 Allowed 'General case' 0 CA--C 1.553 1.067 0 O-C-N 121.126 -0.984 . . . . 0.0 112.459 176.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 53.9 tp -86.78 154.43 20.93 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.763 1.225 . . . . 0.0 112.575 -177.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 75.2 m -77.29 140.65 65.51 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 123.912 0.885 . . . . 0.0 112.716 174.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.21 -24.55 37.86 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 123.842 3.028 . . . . 0.0 114.278 -176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.23 91.61 Favored Glycine 0 CA--C 1.535 1.287 0 C-N-CA 123.647 0.641 . . . . 0.0 113.94 177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -88.2 -34.3 17.85 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.322 1.049 . . . . 0.0 112.516 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . 0.401 ' HG3' ' HG2' ' A' ' 494' ' ' MET . 13.2 tmm? -48.35 -49.34 34.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.076 1.351 . . . . 0.0 113.212 178.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.61 -47.56 85.11 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.849 0.86 . . . . 0.0 111.691 178.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.3 mtmm -60.34 -30.92 69.84 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.215 1.806 . . . . 0.0 114.38 174.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -80.83 -40.06 25.54 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.956 -1.09 . . . . 0.0 113.61 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -56.22 -43.48 78.61 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 119.073 0.851 . . . . 0.0 111.725 173.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . 0.422 ' HA ' HD11 ' A' ' 524' ' ' LEU . 9.6 p -71.08 -40.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 122.88 0.472 . . . . 0.0 112.254 176.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 6.4 tt -66.72 -32.57 73.96 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.447 0.567 . . . . 0.0 112.524 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 41.6 mt -54.62 -57.96 9.37 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.413 1.006 . . . . 0.0 112.213 170.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . 0.41 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -56.13 -33.49 65.21 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 174.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.26 -32.83 74.34 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.856 1.262 . . . . 0.0 113.733 173.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 6.6 mp -80.51 -33.95 36.03 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.648 0.779 . . . . 0.0 112.456 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.12 102.06 2.63 Favored Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 124.078 0.951 . . . . 0.0 111.713 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.85 21.86 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.615 3.543 . . . . 0.0 113.45 178.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.7 -39.95 2.81 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.294 1.838 . . . . 0.0 113.144 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -84.53 -46.38 11.66 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 174.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 515' ' ' ALA . 8.3 tt -121.19 127.73 51.78 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 124.844 1.258 . . . . 0.0 109.812 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 72.2 m -129.89 131.97 46.23 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.229 1.011 . . . . 0.0 110.525 173.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 512' ' ' VAL . 15.3 mt -82.42 134.7 35.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 169.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 31.1 m80 -127.3 111.48 13.96 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 122.724 1.25 . . . . 0.0 110.626 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.02 118.06 26.14 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.403 1.081 . . . . 0.0 109.106 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -162.36 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 C-N-CA 124.603 1.161 . . . . 0.0 110.365 -176.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 64.7 mtm180 -46.53 -38.51 9.48 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 119.958 -1.714 . . . . 0.0 115.562 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 8.1 t -154.62 -22.56 0.12 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -92.79 173.04 7.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.368 1.467 . . . . 0.0 112.757 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 6.9 m -122.16 123.09 40.7 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.848 0.859 . . . . 0.0 110.95 170.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -104.85 149.05 26.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.137 0.975 . . . . 0.0 110.319 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 9.3 p -117.46 139.57 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 124.336 1.054 . . . . 0.0 111.183 173.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -119.93 129.42 54.32 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.931 1.292 . . . . 0.0 110.697 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.88 152.52 50.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.039 1.735 . . . . 0.0 112.686 175.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -92.3 108.21 19.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.749 -0.594 . . . . 0.0 111.071 171.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -70.4 -18.27 63.03 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.01 -3.15 58.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.658 1.583 . . . . 0.0 113.126 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -67.67 155.41 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 124.159 0.984 . . . . 0.0 111.437 174.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -74.83 112.93 11.54 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 121.607 -0.683 . . . . 0.0 110.004 173.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 471' ' ' ARG . 0.3 OUTLIER -56.18 -46.51 79.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.349 0.66 . . . . 0.0 111.487 -175.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.43 28.49 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -74.79 -40.96 35.45 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.332 0.968 . . . . 0.0 113.246 171.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.23 -58.02 7.78 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.386 1.074 . . . . 0.0 112.17 177.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.8 t -63.0 -19.43 64.34 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.426 -0.796 . . . . 0.0 112.732 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -78.02 -41.38 35.93 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 170.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -81.7 -35.12 30.18 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 121.138 -0.976 . . . . 0.0 113.626 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -18.9 61.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.282 1.433 . . . . 0.0 113.236 174.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -46.03 -23.17 0.28 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.876 1.67 . . . . 0.0 114.937 170.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -50.74 -32.59 20.09 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.247 1.019 . . . . 0.0 113.432 172.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.56 -32.32 28.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 169.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.94 -26.8 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 120.83 -1.169 . . . . 0.0 112.137 173.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -59.17 -17.05 23.81 Favored 'General case' 0 CA--C 1.553 1.08 0 O-C-N 120.655 -1.278 . . . . 0.0 114.276 169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.42 -30.85 67.2 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.703 1.138 . . . . 0.0 113.797 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.88 -24.28 11.33 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.465 1.106 . . . . 0.0 112.87 169.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 100.19 45.88 1.96 Allowed Glycine 0 CA--C 1.539 1.556 0 CA-C-O 118.473 -1.182 . . . . 0.0 115.352 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.762 2.025 . . . . 0.0 113.225 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.983 0 CA-C-O 119.533 -0.593 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.13 -66.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 124.401 3.4 . . . . 0.0 113.502 -171.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 20.2 mt 38.74 36.48 0.15 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 129.294 3.037 . . . . 0.0 116.906 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 173.99 -59.8 0.13 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.451 1.024 . . . . 0.0 114.209 174.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 74.0 m -84.21 -39.41 19.37 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 24.5 ptp 38.76 40.89 0.45 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 127.235 2.214 . . . . 0.0 116.476 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 61.8 m -154.97 149.73 26.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 125.749 1.62 . . . . 0.0 110.889 -177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 54.38 32.75 17.09 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.162 1.785 . . . . 0.0 115.164 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 93.5 m -130.77 58.26 37.55 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.315 1.446 . . . . 0.0 112.836 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.38 -11.59 26.42 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 123.57 2.846 . . . . 0.0 114.642 -177.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.07 -20.33 60.99 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 170.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.23 -27.01 68.69 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.819 0.847 . . . . 0.0 111.937 177.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . 0.446 ' HB2' HE21 ' A' ' 461' ' ' GLN . 5.1 pt-20 -86.19 -42.34 13.91 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 118.296 -0.859 . . . . 0.0 112.98 175.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.99 -25.31 20.3 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.3 ptm85 -83.7 -38.14 21.83 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.137 0.975 . . . . 0.0 113.184 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.92 -32.29 27.32 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.359 0.664 . . . . 0.0 112.432 176.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . 0.446 HE21 ' HB2' ' A' ' 457' ' ' GLU . 31.6 mm-40 -62.42 -51.75 66.29 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.692 -1.255 . . . . 0.0 110.314 174.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -58.81 -32.69 69.59 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.852 -1.155 . . . . 0.0 113.367 176.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -36.57 82.17 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.03 -29.88 23.11 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.837 1.198 . . . . 0.0 112.581 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -66.68 -50.14 63.86 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 123.997 0.919 . . . . 0.0 111.66 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 15.3 mt -46.38 -55.36 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 173.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -74.02 -39.06 1.87 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 125.043 3.829 . . . . 0.0 114.072 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -60.69 -55.21 35.92 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 119.171 0.896 . . . . 0.0 111.267 172.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.554 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.6 mm? -55.64 -31.73 62.58 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.298 -0.876 . . . . 0.0 111.422 176.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -64.77 -30.23 71.23 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -28.02 25.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.118 0.872 . . . . 0.0 112.89 176.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.554 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.7 m -89.38 -26.89 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.6 mp -54.94 -36.89 65.77 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.05 1.295 . . . . 0.0 113.066 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.66 69.37 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.84 -0.537 . . . . 0.0 112.142 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.99 -36.33 64.53 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.831 0.852 . . . . 0.0 111.369 174.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 493' ' ' ARG . 38.2 t -66.49 -42.26 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 111.674 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -57.75 -52.64 64.62 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.541 1.136 . . . . 0.0 112.071 174.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -76.12 -31.59 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.427 1.091 . . . . 0.0 113.253 -175.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 59.7 m -68.38 -19.94 64.65 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.766 -1.209 . . . . 0.0 113.48 175.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -91.28 -21.5 21.04 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.028 1.331 . . . . 0.0 113.308 169.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? 57.89 44.58 19.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.334 1.854 . . . . 0.0 113.529 -175.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -135.4 147.22 61.06 Favored Pre-proline 0 CA--C 1.546 0.79 0 O-C-N 121.302 -0.874 . . . . 0.0 112.217 -177.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -73.78 -21.81 18.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.615 2.877 . . . . 0.0 113.68 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.74 136.89 31.22 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.842 1.657 . . . . 0.0 109.733 176.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.4 mp -120.75 133.76 55.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.908 1.283 . . . . 0.0 109.247 -175.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.48 158.32 32.78 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.748 -0.595 . . . . 0.0 109.545 178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -26.94 6.24 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 169.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.25 -44.86 86.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.936 1.694 . . . . 0.0 112.316 175.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.3 t -71.11 -55.48 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 123.619 0.768 . . . . 0.0 110.792 173.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.0 t -60.28 -42.77 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.352 -169.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 12.6 t -61.66 -22.21 65.1 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.01 -53.16 5.25 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 120.526 -1.359 . . . . 0.0 111.918 169.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.646 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -65.55 -41.54 92.9 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.039 1.336 . . . . 0.0 112.58 -171.22 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.412 ' HE3' ' CG2' ' A' ' 495' ' ' VAL . 0.0 OUTLIER -56.95 -20.81 25.74 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 169.743 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . 0.412 ' CG2' ' HE3' ' A' ' 494' ' ' MET . 4.6 t -86.32 -54.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.576 1.151 . . . . 0.0 112.623 171.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -91.98 -33.76 14.72 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -169.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.53 -39.47 31.85 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 175.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.73 143.66 57.39 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.132 -0.98 . . . . 0.0 110.985 169.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -60.81 -31.07 70.48 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 176.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.6 m -106.37 116.83 32.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.344 1.458 . . . . 0.0 112.091 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -67.66 98.55 0.7 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.466 1.106 . . . . 0.0 113.008 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 62.4 tp -81.07 152.08 28.04 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.696 1.198 . . . . 0.0 112.395 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 3.2 m -68.93 147.55 97.82 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -67.14 -23.94 45.19 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 124.173 3.249 . . . . 0.0 114.13 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -80.66 -40.62 12.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 123.824 0.726 . . . . 0.0 114.074 176.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -71.78 -39.34 70.01 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 117.971 0.886 . . . . 0.0 112.602 176.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -32.75 63.38 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.27 -45.97 90.87 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -70.61 -29.59 66.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -77.34 -46.09 24.01 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.342 1.057 . . . . 0.0 112.972 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 23.8 mt -57.72 -42.76 84.46 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.347 1.059 . . . . 0.0 112.414 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.88 -35.54 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.307 0.643 . . . . 0.0 112.22 174.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.74 -47.28 64.11 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.668 0.787 . . . . 0.0 112.55 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.97 -57.29 10.81 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.97 0.805 . . . . 0.0 111.657 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . 0.403 ' HB2' HD23 ' A' ' 522' ' ' LEU . . . -58.51 -28.01 65.02 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 114.077 1.139 . . . . 0.0 114.077 175.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -73.06 -24.33 60.67 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.18 1.392 . . . . 0.0 113.168 175.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 27.6 mt -90.41 -35.7 15.02 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.016 0.825 . . . . 0.0 112.473 173.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -152.17 102.11 2.8 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 123.914 0.886 . . . . 0.0 111.574 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -73.36 19.51 0.37 Allowed 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 124.454 3.436 . . . . 0.0 113.427 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -116.13 -33.31 5.07 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.124 1.77 . . . . 0.0 112.979 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -85.11 -47.73 9.88 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . 0.403 HD23 ' HB2' ' A' ' 515' ' ' ALA . 10.0 tt -123.89 131.89 53.65 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.096 1.358 . . . . 0.0 110.392 178.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.2 m -129.85 127.15 39.65 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.985 1.314 . . . . 0.0 111.351 177.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 13.9 mt -82.22 128.76 34.49 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.2 152.78 42.5 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.949 1.7 . . . . 0.0 112.043 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -120.48 124.35 45.2 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.97 -1.081 . . . . 0.0 109.814 -177.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.62 -164.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.102 0 C-N-CA 123.603 0.761 . . . . 0.0 110.708 178.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 5.4 mmp_? -44.09 -37.66 3.19 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.171 1.788 . . . . 0.0 115.708 172.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.5 t -155.97 -23.21 0.1 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -90.32 173.42 8.13 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.898 1.679 . . . . 0.0 113.147 173.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 3.8 m -121.7 121.59 37.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.942 1.297 . . . . 0.0 111.053 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -114.44 143.63 44.62 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.461 1.104 . . . . 0.0 112.346 176.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 14.8 p -111.16 146.82 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 120.736 -1.227 . . . . 0.0 110.963 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -125.99 126.97 45.18 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.207 1.403 . . . . 0.0 110.072 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.19 152.42 50.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.399 1.88 . . . . 0.0 112.18 174.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -87.73 107.21 18.53 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 119.216 0.917 . . . . 0.0 110.684 171.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -15.66 62.0 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.478 1.111 . . . . 0.0 113.581 178.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -88.81 -6.9 57.05 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.601 1.56 . . . . 0.0 113.7 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.7 p -67.98 155.11 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.487 1.115 . . . . 0.0 111.837 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.16 126.2 31.2 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.677 -0.639 . . . . 0.0 111.019 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . 0.406 ' O ' HG22 ' A' ' 545' ' ' THR . 31.0 tp -52.09 -51.05 60.18 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.141 0.976 . . . . 0.0 112.132 175.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.42 -21.34 24.61 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.147 0.979 . . . . 0.0 113.351 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -80.34 -42.34 10.6 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.118 0.866 . . . . 0.0 113.13 172.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 96.8 mt -64.17 -57.95 8.04 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.689 1.196 . . . . 0.0 113.08 174.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . 0.452 ' HA ' HD22 ' A' ' 548' ' ' LEU . 0.6 OUTLIER -59.83 -29.99 68.64 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 121.335 -0.853 . . . . 0.0 111.79 -178.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.14 95.33 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.589 -1.319 . . . . 0.0 113.942 175.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -86.39 -36.57 19.09 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 177.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 545' ' ' THR . 0.0 OUTLIER -75.19 -20.22 59.41 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.881 1.273 . . . . 0.0 113.404 177.24 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -53.29 -23.32 8.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.808 1.243 . . . . 0.0 113.824 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -50.12 -32.27 15.52 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.646 0.778 . . . . 0.0 113.048 174.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -82.19 -40.52 21.61 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -69.69 -21.92 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 120.978 -1.076 . . . . 0.0 113.417 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -53.15 -17.22 1.49 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.547 1.939 . . . . 0.0 114.575 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.39 -37.3 36.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.681 1.592 . . . . 0.0 114.325 169.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -109.22 -23.88 11.39 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.314 1.046 . . . . 0.0 113.543 170.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 108.07 32.89 3.14 Favored Glycine 0 CA--C 1.539 1.563 0 N-CA-C 119.205 2.442 . . . . 0.0 119.205 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.308 0 C-N-CA 127.742 2.417 . . . . 0.0 113.468 174.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 CA-C-O 119.113 -0.826 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -63.86 112.26 1.77 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 124.468 3.445 . . . . 0.0 112.489 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 64.1 mt 46.97 41.35 10.78 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.002 1.721 . . . . 0.0 114.45 174.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 86.55 30.92 20.3 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.199 0.904 . . . . 0.0 114.291 -177.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 6.6 t 61.33 79.52 0.25 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.616 1.966 . . . . 0.0 113.363 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 4.1 mmt -44.15 153.27 0.15 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.762 2.025 . . . . 0.0 115.825 176.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m 55.55 59.84 3.66 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.247 1.819 . . . . 0.0 114.451 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 165.05 32.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.396 1.879 . . . . 0.0 112.66 171.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 75.9 m 8.92 81.98 0.05 OUTLIER Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 129.822 3.249 . . . . 0.0 116.474 169.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -61.66 -19.27 64.41 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 123.165 2.577 . . . . 0.0 114.981 -170.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.85 -21.95 66.69 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -31.14 70.88 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.058 0.943 . . . . 0.0 112.091 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -86.06 -41.32 14.9 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.208 177.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 40.7 mt -52.76 -25.69 11.99 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 18.8 ptt180 -79.64 -46.18 17.68 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.027 0.931 . . . . 0.0 112.245 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.78 -29.72 29.42 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.566 0.746 . . . . 0.0 112.195 -177.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -60.27 -48.16 82.93 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 169.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 25.0 ttp-105 -54.22 -44.28 71.55 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.524 -0.735 . . . . 0.0 112.617 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.501 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -59.72 -34.64 73.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 177.325 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.501 ' N ' HD23 ' A' ' 463' ' ' LEU . 10.1 pt-20 -85.94 -22.46 27.4 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 120.379 1.445 . . . . 0.0 113.477 176.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -83.08 -41.91 18.04 Favored 'General case' 0 C--O 1.216 -0.707 0 C-N-CA 124.645 1.178 . . . . 0.0 110.872 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -45.96 -55.83 12.0 Favored Pre-proline 0 CA--C 1.563 1.459 0 C-N-CA 125.129 1.372 . . . . 0.0 114.424 170.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.15 -38.97 3.34 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 125.022 3.814 . . . . 0.0 113.234 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -63.6 -51.45 65.21 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.921 0.888 . . . . 0.0 112.513 174.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.539 ' HA ' HG22 ' A' ' 472' ' ' VAL . 2.3 mm? -55.16 -31.96 61.76 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.783 -0.573 . . . . 0.0 111.864 173.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -59.25 -38.13 79.3 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.387 -0.821 . . . . 0.0 112.402 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 -31.93 27.1 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.529 -0.732 . . . . 0.0 111.913 -178.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -81.06 -25.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.169 -0.957 . . . . 0.0 112.655 177.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.8 mp -55.93 -41.88 75.27 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.178 1.354 . . . . 0.0 112.887 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -58.85 -43.49 90.77 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.746 1.218 . . . . 0.0 111.184 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -72.53 -35.68 68.13 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.098 0.959 . . . . 0.0 113.037 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.668 HG13 ' HB3' ' A' ' 493' ' ' ARG . 31.8 t -66.67 -42.8 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.868 1.667 . . . . 0.0 111.571 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -55.19 -52.82 62.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.996 1.318 . . . . 0.0 112.087 174.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 10.8 p -77.6 -31.3 17.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.586 1.154 . . . . 0.0 113.429 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 74.8 m -62.64 -32.97 74.1 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.083 0.856 . . . . 0.0 112.229 174.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -90.99 -13.92 32.43 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.255 1.205 . . . . 0.0 114.255 174.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 68.19 29.25 6.2 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 126.123 1.769 . . . . 0.0 113.89 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -132.13 152.34 80.0 Favored Pre-proline 0 N--CA 1.481 1.088 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -176.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.59 -20.39 13.86 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 124.041 3.161 . . . . 0.0 114.685 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.96 127.22 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.167 1.387 . . . . 0.0 109.686 -177.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.2 mp -118.6 130.22 55.76 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.425 1.09 . . . . 0.0 109.999 -172.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.45 158.18 27.36 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.462 -0.774 . . . . 0.0 109.579 178.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.64 2.25 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -68.04 -43.42 78.74 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.824 1.25 . . . . 0.0 112.521 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 11.8 t -67.97 -54.05 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.723 0.809 . . . . 0.0 110.647 170.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.78 -38.75 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -169.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.57 -28.36 63.5 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.65 -45.07 12.05 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.604 -1.31 . . . . 0.0 112.965 169.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.668 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -78.85 -49.55 12.73 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.626 1.17 . . . . 0.0 113.127 -169.553 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -22.02 41.01 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 120.521 -1.362 . . . . 0.0 113.309 171.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 99.5 t -85.68 -51.01 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.287 1.035 . . . . 0.0 111.982 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -92.86 -35.18 13.51 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.3 t -73.87 -37.99 64.58 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 118.81 0.732 . . . . 0.0 112.475 174.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.512 ' SG ' HG11 ' A' ' 472' ' ' VAL . 42.1 t -64.18 148.47 49.94 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.097 -1.002 . . . . 0.0 110.934 169.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -62.28 -33.15 74.07 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.654 0.781 . . . . 0.0 112.304 173.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 2.6 m -106.17 122.41 46.15 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.005 2.122 . . . . 0.0 111.909 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -74.38 145.18 43.98 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 120.579 -1.326 . . . . 0.0 110.814 169.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 37.9 tp -121.19 152.12 39.16 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.483 1.913 . . . . 0.0 112.286 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 65.5 m -68.11 147.55 98.35 Favored Pre-proline 0 CA--C 1.551 0.991 0 O-C-N 121.416 -0.802 . . . . 0.0 113.029 172.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -67.66 -24.21 41.63 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.73 2.954 . . . . 0.0 114.43 -176.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -68.99 -39.3 85.06 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 123.474 0.559 . . . . 0.0 113.67 174.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -78.48 -35.56 46.42 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.031 0.932 . . . . 0.0 112.812 174.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -45.58 -51.93 11.3 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.842 1.257 . . . . 0.0 113.605 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -67.71 -42.27 82.25 Favored 'General case' 0 N--CA 1.479 0.981 0 O-C-N 121.638 -0.664 . . . . 0.0 112.668 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.19 -26.81 66.65 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.612 1.565 . . . . 0.0 113.837 170.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -80.41 -43.88 20.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.355 1.462 . . . . 0.0 112.83 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.86 -42.51 98.0 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.667 0.787 . . . . 0.0 111.98 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . 0.509 ' HA ' HD11 ' A' ' 524' ' ' LEU . 7.1 p -65.6 -36.02 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 173.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.11 -37.53 77.41 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.06 -59.33 5.53 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 118.839 0.745 . . . . 0.0 111.058 174.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -57.32 -33.78 68.06 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.111 -0.993 . . . . 0.0 113.597 177.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.05 -25.65 64.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.92 1.288 . . . . 0.0 114.033 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 4.6 mp -86.9 -37.62 17.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.913 0.885 . . . . 0.0 111.527 171.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -155.34 108.04 2.23 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.88 1.272 . . . . 0.0 111.659 174.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.42 2.93 3.97 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.219 2.613 . . . . 0.0 113.177 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -81.39 -36.34 29.68 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.393 1.477 . . . . 0.0 113.513 -170.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -98.23 -44.09 6.72 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.988 0.915 . . . . 0.0 113.261 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 9.2 tt -117.49 131.39 56.73 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.875 1.27 . . . . 0.0 110.524 178.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 24.8 m -129.64 126.04 37.47 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 126.025 1.73 . . . . 0.0 110.642 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 512' ' ' VAL . 6.4 mt -82.38 137.38 34.76 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.668 0.787 . . . . 0.0 109.16 170.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -138.16 119.87 15.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.499 1.12 . . . . 0.0 112.57 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 3.6 tpp180 -81.91 126.45 31.93 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.312 -0.867 . . . . 0.0 109.345 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -84.41 -161.06 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.313 1.045 . . . . 0.0 109.83 173.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -46.31 -45.4 17.42 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.104 -1.623 . . . . 0.0 115.262 173.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.4 p -146.08 -22.79 0.45 Allowed 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -92.89 175.96 6.6 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.494 1.518 . . . . 0.0 113.079 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.9 m -121.8 123.0 40.77 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.978 0.911 . . . . 0.0 111.047 173.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -105.73 152.24 23.42 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.041 1.336 . . . . 0.0 110.496 173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 46.5 t -117.39 138.59 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 124.898 1.279 . . . . 0.0 110.224 175.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -119.81 127.53 52.86 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.754 1.622 . . . . 0.0 110.267 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.24 152.6 50.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.285 1.834 . . . . 0.0 112.485 171.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -84.05 108.18 16.84 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.417 -0.802 . . . . 0.0 110.734 170.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 8.7 ptmt -70.58 -17.22 62.91 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -90.07 -2.77 58.16 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.372 1.469 . . . . 0.0 113.764 -174.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.416 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.2 p -68.34 155.01 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 125.068 1.347 . . . . 0.0 112.197 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -81.08 102.59 10.33 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.112 -0.993 . . . . 0.0 110.332 174.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -48.37 -46.16 36.56 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.917 1.287 . . . . 0.0 112.918 -169.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.87 -24.95 39.99 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.96 -41.13 88.45 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 124.615 1.102 . . . . 0.0 113.427 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.459 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.0 mm? -72.71 -57.14 4.34 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.674 1.59 . . . . 0.0 110.332 -173.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.6 t -57.86 -23.93 55.22 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -75.94 -40.96 53.04 Favored 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 171.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 2.0 ptm85 -81.31 -33.39 32.59 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.958 -1.089 . . . . 0.0 113.666 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.43 -19.29 61.01 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 125.286 1.434 . . . . 0.0 112.542 171.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.43 -23.68 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 174.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -50.24 -31.33 13.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.698 1.199 . . . . 0.0 113.558 170.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -82.22 -44.87 15.8 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.456 1.102 . . . . 0.0 112.982 173.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.52 -30.4 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 125.507 1.523 . . . . 0.0 112.886 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -57.98 -16.87 13.91 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 170.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -51.19 -42.02 60.62 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 119.986 1.266 . . . . 0.0 113.28 173.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -109.04 -23.4 11.69 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.031 1.732 . . . . 0.0 113.019 174.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.86 56.47 1.51 Allowed Glycine 0 CA--C 1.535 1.333 0 CA-C-O 119.007 -0.885 . . . . 0.0 114.621 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.158 0 C-N-CA 127.765 2.426 . . . . 0.0 113.805 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.867 0 CA-C-O 119.699 -0.5 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.74 171.23 16.88 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 124.072 3.181 . . . . 0.0 111.973 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -62.78 -17.5 61.19 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 176.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 120.34 -33.65 4.43 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 126.041 1.782 . . . . 0.0 113.734 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 88.2 p -89.74 32.53 0.88 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.226 1.81 . . . . 0.0 113.156 176.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.62 146.65 16.06 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.375 1.47 . . . . 0.0 112.231 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 68.3 p -60.03 170.79 1.12 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.812 1.245 . . . . 0.0 113.737 176.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 26.0 ptt180 -69.46 43.35 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 127.616 2.366 . . . . 0.0 115.996 -178.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 4.8 t -84.65 135.89 40.07 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 126.142 1.777 . . . . 0.0 113.103 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -70.06 -13.25 33.69 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.486 2.791 . . . . 0.0 114.696 177.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.47 -20.25 63.75 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 120.719 1.599 . . . . 0.0 114.241 171.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -30.59 65.89 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.605 0.762 . . . . 0.0 112.333 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -86.12 -43.85 12.72 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 118.367 -0.825 . . . . 0.0 112.755 176.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.5 mt -54.82 -25.17 26.56 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -81.33 -39.88 24.46 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.04 0.936 . . . . 0.0 112.8 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.796 ' HA ' HD23 ' A' ' 463' ' ' LEU . 0.7 OUTLIER -83.12 -27.73 29.95 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.073 0.949 . . . . 0.0 112.297 176.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -62.4 -55.42 28.05 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.448 1.022 . . . . 0.0 109.55 170.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -57.08 -29.68 63.69 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.417 1.266 . . . . 0.0 114.417 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 460' ' ' LEU . 0.3 OUTLIER -57.76 -44.22 86.01 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 179.191 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -85.78 -20.33 29.4 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.73 1.612 . . . . 0.0 113.018 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -71.34 -46.13 61.27 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 124.116 0.966 . . . . 0.0 110.143 176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.432 ' HB3' HD11 ' A' ' 548' ' ' LEU . 22.5 mt -47.75 -56.17 14.36 Favored Pre-proline 0 CA--C 1.563 1.468 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.84 -36.82 7.37 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 124.979 3.786 . . . . 0.0 113.704 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.45 -53.35 56.15 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.811 0.732 . . . . 0.0 111.016 170.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.556 ' HA ' HG22 ' A' ' 472' ' ' VAL . 17.0 mt -55.23 -29.9 58.93 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.775 -0.578 . . . . 0.0 112.135 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -60.47 -30.72 69.85 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 174.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.11 -27.4 24.68 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.168 -0.958 . . . . 0.0 113.539 175.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 469' ' ' LEU . 1.8 m -89.55 -25.7 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 121.225 -0.922 . . . . 0.0 113.331 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -41.13 82.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.752 1.16 . . . . 0.0 112.065 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -36.63 84.21 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.504 -0.748 . . . . 0.0 111.991 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 478' ' ' VAL . 50.6 m-80 -67.56 -35.65 79.45 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.062 0.945 . . . . 0.0 112.175 175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.767 HG13 ' HB3' ' A' ' 493' ' ' ARG . 50.1 t -65.31 -42.49 93.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.878 1.271 . . . . 0.0 111.941 174.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -66.11 -45.01 82.63 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.401 HG12 ' HA ' ' A' ' 475' ' ' ASN . 9.3 p -74.49 -30.74 26.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 33.2 t -59.92 -34.72 73.6 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.656 1.116 . . . . 0.0 112.577 175.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -90.64 -15.17 30.91 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.101 1.361 . . . . 0.0 113.331 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 34.4 mtt-85 58.8 40.5 22.88 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.977 1.711 . . . . 0.0 113.372 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -130.83 146.06 60.38 Favored Pre-proline 0 CA--C 1.549 0.917 0 O-C-N 121.305 -0.872 . . . . 0.0 112.584 -179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -76.42 -16.64 17.06 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.14 3.227 . . . . 0.0 113.914 178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.9 143.03 33.1 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.325 1.85 . . . . 0.0 109.846 173.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 47.5 mt -123.04 136.28 54.77 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.514 1.126 . . . . 0.0 110.616 -178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.06 154.83 35.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.855 0.752 . . . . 0.0 109.209 174.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.97 -30.22 1.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 169.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -70.45 -39.0 74.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.905 1.282 . . . . 0.0 112.58 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.2 t -71.89 -51.81 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 123.105 0.562 . . . . 0.0 110.509 170.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 19.3 t -61.13 -41.88 91.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 118.832 0.742 . . . . 0.0 111.321 -169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 96.7 m -66.87 -20.83 65.99 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 175.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.67 -40.1 16.53 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.765 1.166 . . . . 0.0 113.344 169.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.767 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -84.29 -43.82 14.43 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 120.925 -1.109 . . . . 0.0 112.16 -173.571 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -62.54 -24.65 67.63 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 120.513 -1.367 . . . . 0.0 113.331 175.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 4.7 p -86.16 -41.64 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -92.82 -41.89 9.85 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.5 t -72.1 -40.96 67.82 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.529 0.732 . . . . 0.0 112.841 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.1 140.65 56.23 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.016 -1.053 . . . . 0.0 111.15 169.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -57.97 -26.92 62.95 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 175.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 46.6 m -105.81 116.53 32.09 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.412 1.485 . . . . 0.0 111.251 174.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -84.06 114.74 21.96 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.409 1.084 . . . . 0.0 111.48 177.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 34.2 tp -80.84 161.34 24.49 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.944 1.298 . . . . 0.0 112.404 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.4 m -74.49 145.08 81.87 Favored Pre-proline 0 CA--C 1.549 0.937 0 O-C-N 120.535 -1.353 . . . . 0.0 112.619 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.14 -25.1 43.83 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 123.716 2.944 . . . . 0.0 114.81 -176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -76.03 -30.1 57.88 Favored Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.514 0.578 . . . . 0.0 113.872 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -83.92 -33.15 24.78 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.202 1.401 . . . . 0.0 112.587 174.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 8.5 mtm -48.49 -54.21 15.13 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -55.65 -44.66 77.4 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 509' ' ' LYS . 0.0 OUTLIER -65.59 -35.39 80.69 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.285 1.834 . . . . 0.0 113.679 177.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 20.8 m80 -75.54 -43.08 50.6 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.298 1.039 . . . . 0.0 112.217 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 98.0 mt -63.34 -40.59 97.73 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.1 p -74.42 -36.63 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.769 0.828 . . . . 0.0 112.918 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 46.5 tp -53.2 -43.91 67.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.392 0.677 . . . . 0.0 112.228 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -53.88 -54.02 44.4 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 119.499 1.045 . . . . 0.0 112.432 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -60.91 -26.44 67.46 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 174.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -72.59 -20.82 61.23 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.712 1.205 . . . . 0.0 113.595 173.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 57.0 mt -94.72 -33.7 12.83 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.446 0.699 . . . . 0.0 112.311 174.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.69 103.72 2.7 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 124.117 0.967 . . . . 0.0 112.678 172.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.52 20.16 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.195 0 C-N-CA 124.314 3.343 . . . . 0.0 112.806 169.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -109.72 -11.03 14.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.583 2.353 . . . . 0.0 113.541 -173.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -128.63 -46.65 1.29 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.71 1.204 . . . . 0.0 113.736 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 6.5 tt -108.72 126.54 53.11 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.259 1.023 . . . . 0.0 109.735 169.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 75.0 m -129.64 125.54 36.3 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.779 0.832 . . . . 0.0 111.781 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.88 116.95 22.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 169.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.1 m80 -101.2 152.72 20.32 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.972 1.709 . . . . 0.0 110.613 169.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -127.72 119.77 26.51 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 120.657 -1.277 . . . . 0.0 110.163 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.7 tp -84.57 -163.84 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 124.767 1.227 . . . . 0.0 110.979 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 -42.48 -46.76 4.9 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.336 -1.478 . . . . 0.0 114.976 173.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 38.5 p -146.72 -22.67 0.42 Allowed 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 176.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -90.49 172.51 8.66 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.622 1.569 . . . . 0.0 113.161 174.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.9 m -121.78 118.44 29.04 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.19 1.396 . . . . 0.0 111.248 177.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -112.77 139.45 48.38 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.936 0.895 . . . . 0.0 112.45 175.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.5 p -102.42 151.61 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.667 -1.27 . . . . 0.0 109.973 176.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -127.09 127.01 43.98 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.1 1.36 . . . . 0.0 110.289 173.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -134.75 132.75 39.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.446 1.898 . . . . 0.0 110.548 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -84.13 108.2 16.91 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.6 1.091 . . . . 0.0 110.629 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.12 -10.69 59.61 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.07 -5.45 44.31 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.504 1.521 . . . . 0.0 114.406 -176.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.535 ' CG1' HD21 ' A' ' 544' ' ' LEU . 4.5 p -67.05 154.82 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.903 0.881 . . . . 0.0 112.064 176.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -75.67 125.6 29.37 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.347 -0.846 . . . . 0.0 110.706 169.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 52.3 tp -51.11 -50.2 59.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.726 0.811 . . . . 0.0 112.899 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.69 -21.42 27.54 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.51 1.124 . . . . 0.0 112.285 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.38 -47.36 51.84 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-O 119.288 -0.729 . . . . 0.0 113.691 173.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.535 HD21 ' CG1' ' A' ' 539' ' ' VAL . 1.1 mm? -67.66 -55.72 12.16 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 118.943 1.372 . . . . 0.0 112.125 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 7.0 t -60.39 -19.18 55.02 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 121.119 -0.988 . . . . 0.0 112.889 -178.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -74.13 -46.52 42.01 Favored 'General case' 0 CA--C 1.551 1.003 0 O-C-N 121.284 -0.885 . . . . 0.0 113.197 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -86.27 -35.38 19.99 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -176.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.432 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -69.62 -20.84 63.6 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.005 1.322 . . . . 0.0 111.7 177.081 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -47.68 -23.83 0.78 Allowed 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 -177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -51.55 -32.28 27.56 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 176.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -82.58 -40.82 20.37 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 173.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.3 m -69.31 -25.63 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.019 -1.051 . . . . 0.0 112.791 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -52.88 -16.62 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.313 2.245 . . . . 0.0 114.413 169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.29 -37.59 56.06 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 171.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.524 ' HB2' HD22 ' A' ' 463' ' ' LEU . 44.4 mm-40 -109.0 -23.61 11.61 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.258 1.423 . . . . 0.0 114.333 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 86.57 71.83 1.3 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 123.929 0.776 . . . . 0.0 114.379 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 C--O 1.252 1.224 0 C-N-CA 125.983 1.713 . . . . 0.0 113.217 174.307 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 CA-C-O 118.672 -1.071 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.27 173.81 13.11 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.607 3.538 . . . . 0.0 112.514 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -56.71 -28.24 60.58 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 173.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 140.06 163.59 9.57 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 126.19 1.853 . . . . 0.0 113.193 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.8 t 59.58 -48.49 0.08 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 128.615 2.766 . . . . 0.0 117.066 -177.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 11.8 ptt? 38.88 36.72 0.16 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 128.807 2.843 . . . . 0.0 117.049 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 23.2 m 60.96 113.65 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.521 1.928 . . . . 0.0 114.159 -169.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 3.8 mtp180 -78.28 62.71 3.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.513 1.525 . . . . 0.0 112.942 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 8.5 t -146.4 135.53 11.32 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 125.254 1.422 . . . . 0.0 111.543 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -67.94 -8.2 21.93 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.276 2.651 . . . . 0.0 114.413 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.26 -20.28 59.27 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.559 1.527 . . . . 0.0 114.607 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.66 -29.41 64.59 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.297 0.639 . . . . 0.0 111.9 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.95 -46.28 10.7 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.242 1.017 . . . . 0.0 113.029 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.4 mt -56.01 -24.97 42.36 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.427 1.012 . . . . 0.0 113.059 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 5.3 ptm85 -76.7 -44.8 32.02 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.445 0.698 . . . . 0.0 111.54 177.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 -30.19 31.63 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 121.258 -0.902 . . . . 0.0 112.215 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -61.61 -34.69 76.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.152 -0.967 . . . . 0.0 111.148 171.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 46.0 ttp180 -66.3 -41.58 89.53 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.44 -0.787 . . . . 0.0 112.643 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 555' ' ' GLU . 0.0 OUTLIER -59.75 -27.29 66.38 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 115.152 1.538 . . . . 0.0 115.152 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -85.39 -16.76 38.76 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.517 1.053 . . . . 0.0 112.852 173.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -85.28 -47.15 10.33 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 124.324 1.05 . . . . 0.0 110.608 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -42.98 -54.25 9.19 Favored Pre-proline 0 CA--C 1.564 1.484 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 171.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.31 -41.69 0.84 Allowed 'Trans proline' 0 C--N 1.354 0.861 0 C-N-CA 124.797 3.665 . . . . 0.0 113.506 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -62.2 -53.43 55.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.093 0.957 . . . . 0.0 111.671 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.525 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.9 mm? -52.38 -34.13 46.45 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.619 0.768 . . . . 0.0 111.435 175.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -63.18 -45.86 89.79 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.359 -0.838 . . . . 0.0 112.508 174.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -23.42 49.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -177.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.525 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.4 m -89.29 -23.7 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 171.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -37.87 75.85 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 120.284 1.402 . . . . 0.0 112.421 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -34.3 77.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.663 0.785 . . . . 0.0 111.737 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -71.36 -36.06 71.34 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.02 0.928 . . . . 0.0 111.978 173.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.744 HG13 ' HB3' ' A' ' 493' ' ' ARG . 72.5 t -65.32 -43.76 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 O-C-N 120.695 -1.253 . . . . 0.0 111.678 172.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -57.97 -51.14 70.9 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.894 1.278 . . . . 0.0 112.068 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.9 p -77.14 -31.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.595 1.158 . . . . 0.0 113.623 -176.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.6 m -64.17 -24.72 67.78 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 120.655 -1.278 . . . . 0.0 113.274 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -91.0 -23.21 20.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.852 1.261 . . . . 0.0 113.704 171.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? 58.21 45.49 17.27 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.125 1.77 . . . . 0.0 113.815 -174.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -134.4 147.66 64.44 Favored Pre-proline 0 CA--C 1.547 0.836 0 O-C-N 121.209 -0.932 . . . . 0.0 112.031 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -74.07 -20.94 18.67 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.77 2.98 . . . . 0.0 113.92 179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.92 137.05 31.04 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.972 1.709 . . . . 0.0 109.781 175.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.1 mp -123.55 133.13 54.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.991 1.316 . . . . 0.0 109.603 -175.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.59 157.18 28.81 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.595 -0.691 . . . . 0.0 109.32 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -27.94 3.15 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 169.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.43 -43.26 81.63 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.629 1.172 . . . . 0.0 112.353 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.41 -54.49 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.31 0.644 . . . . 0.0 110.324 170.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.17 -39.77 85.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 119.091 -0.481 . . . . 0.0 111.514 -170.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 45.7 t -57.27 -27.34 62.01 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 174.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.0 -54.17 4.64 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 119.546 1.066 . . . . 0.0 112.649 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.744 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -67.78 -41.03 83.89 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.132 0.973 . . . . 0.0 112.356 -169.705 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.446 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -59.44 -20.17 53.03 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 170.42 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 18.7 t -79.96 -53.3 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 O-C-N 120.421 -1.425 . . . . 0.0 111.224 170.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -92.82 -40.15 10.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.6 t -67.97 -37.44 81.54 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 173.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 35.1 m -72.92 145.13 47.03 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.384 -0.822 . . . . 0.0 112.08 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -63.44 -30.95 71.99 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.7 m -106.26 121.93 45.21 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.895 1.278 . . . . 0.0 111.492 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.53 124.89 25.67 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.213 1.005 . . . . 0.0 111.043 170.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.7 tp -109.55 155.93 20.78 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.867 1.667 . . . . 0.0 112.064 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 50.8 m -71.67 145.35 89.69 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.531 1.132 . . . . 0.0 113.167 175.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.64 -22.49 37.75 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.728 2.952 . . . . 0.0 114.39 -177.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.56 -41.12 77.14 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.698 -0.626 . . . . 0.0 113.732 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -78.22 -36.67 46.82 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.601 1.16 . . . . 0.0 112.786 174.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -46.12 -51.11 14.55 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.329 1.451 . . . . 0.0 113.323 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -67.21 -40.56 86.44 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.846 -0.534 . . . . 0.0 112.403 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 25.4 mtmt -64.23 -29.41 70.52 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.683 1.593 . . . . 0.0 114.104 173.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 15.3 m80 -78.62 -41.82 30.54 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.83 1.252 . . . . 0.0 112.978 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.8 -46.46 89.13 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.819 -0.55 . . . . 0.0 111.803 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.77 -37.61 80.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 122.965 0.506 . . . . 0.0 111.661 176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -41.0 77.9 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 53.0 mt -56.94 -55.49 33.9 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 118.124 0.42 . . . . 0.0 111.978 -178.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.37 -28.58 65.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 173.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.93 -27.05 68.88 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.989 1.316 . . . . 0.0 113.352 177.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 20.1 mt -88.96 -36.84 15.65 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.67 0.788 . . . . 0.0 112.726 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.53 102.44 3.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.046 1.338 . . . . 0.0 110.782 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.46 12.8 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.902 3.068 . . . . 0.0 113.878 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -112.35 -34.3 5.93 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.248 1.819 . . . . 0.0 113.838 -170.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . . . . . . . . . 31.8 t90 -84.19 -46.48 11.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 8.4 tt -123.62 133.12 53.99 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.408 1.483 . . . . 0.0 110.419 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 23.2 m -129.95 125.95 36.68 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.03 1.332 . . . . 0.0 111.948 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.66 113.7 20.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.216 1.406 . . . . 0.0 109.204 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -116.75 120.81 39.73 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.876 1.322 . . . . 0.0 112.027 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -87.65 123.95 33.03 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.93 0.892 . . . . 0.0 110.319 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.68 -166.02 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.046 0.939 . . . . 0.0 110.787 173.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -42.19 -45.81 4.21 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.119 1.768 . . . . 0.0 115.153 173.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.7 p -144.12 -22.52 0.56 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 125.299 1.44 . . . . 0.0 114.76 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -103.09 174.99 5.63 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.513 1.925 . . . . 0.0 112.623 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.0 m -121.49 121.48 37.61 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.124 0.97 . . . . 0.0 110.431 174.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -105.25 140.99 37.56 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.252 1.021 . . . . 0.0 111.222 172.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 4.9 t -106.78 140.57 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.31 1.044 . . . . 0.0 109.783 177.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 33.5 tttm -129.25 126.96 40.24 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.953 1.301 . . . . 0.0 110.469 177.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.14 152.55 50.32 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.85 2.06 . . . . 0.0 112.483 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -87.12 108.05 18.72 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.001 0.819 . . . . 0.0 110.729 169.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -73.35 -14.08 61.22 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 173.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.22 -4.26 59.13 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.304 1.442 . . . . 0.0 113.963 -177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.407 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.3 p -67.69 155.22 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.229 1.411 . . . . 0.0 112.21 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -79.83 100.79 8.16 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.076 -1.015 . . . . 0.0 110.049 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -44.22 54.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.498 1.119 . . . . 0.0 113.118 -169.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.95 -21.91 23.48 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 176.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -71.72 -40.04 59.14 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.057 1.313 . . . . 0.0 113.608 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.436 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.2 mm? -71.95 -57.16 4.54 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.103 1.761 . . . . 0.0 110.502 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.14 -24.79 43.19 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 173.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -77.66 -40.38 41.83 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -86.14 -35.25 20.27 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 120.888 -1.132 . . . . 0.0 113.949 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -19.07 64.45 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.428 1.091 . . . . 0.0 112.329 171.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -49.16 -23.55 1.33 Allowed 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 172.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.53 -32.95 8.72 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 170.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -82.39 -44.88 15.56 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.7 m -67.95 -19.48 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.92 -17.26 1.32 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.433 1.893 . . . . 0.0 114.52 169.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.7 -32.36 42.38 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.486 1.114 . . . . 0.0 113.651 169.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.436 ' HB2' HD13 ' A' ' 463' ' ' LEU . 9.5 mp0 -109.33 -23.59 11.49 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.813 1.645 . . . . 0.0 113.828 172.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 82.34 62.45 1.88 Allowed Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.085 0.85 . . . . 0.0 114.019 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.254 1.301 0 C-N-CA 127.805 2.442 . . . . 0.0 114.926 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.715 0 CA-C-O 118.563 -1.132 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -73.36 -171.91 0.92 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.573 3.515 . . . . 0.0 112.373 175.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 14.3 mt -53.76 169.49 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.184 1.794 . . . . 0.0 113.129 169.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -50.99 138.12 26.94 Favored Glycine 0 CA--C 1.539 1.568 0 O-C-N 121.341 -0.85 . . . . 0.0 113.475 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.7 p 41.14 54.07 3.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.208 1.803 . . . . 0.0 115.661 -176.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 21.9 mtt -127.93 151.08 49.54 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.284 1.434 . . . . 0.0 113.243 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.0 t -144.16 21.38 1.74 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.034 1.734 . . . . 0.0 112.155 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.8 125.99 38.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.502 1.521 . . . . 0.0 111.153 174.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 3.6 t -160.14 137.33 6.84 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.898 1.279 . . . . 0.0 110.821 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.48 -14.05 38.92 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.977 2.451 . . . . 0.0 114.378 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.05 -20.63 64.12 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 120.624 1.556 . . . . 0.0 114.66 172.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -29.68 69.56 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 118.253 0.479 . . . . 0.0 112.184 177.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -86.05 -42.16 14.19 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-O 117.88 -1.057 . . . . 0.0 112.606 176.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 46.7 mt -55.37 -24.03 27.46 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.487 1.04 . . . . 0.0 113.649 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -76.46 -45.3 31.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.242 0.617 . . . . 0.0 111.956 177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.18 -28.74 29.11 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.387 1.075 . . . . 0.0 112.819 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -57.92 -53.61 56.33 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.171 -0.956 . . . . 0.0 109.608 173.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 39.8 ttm105 -50.63 -38.76 47.95 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.99 -1.068 . . . . 0.0 113.211 174.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.48 -34.64 78.74 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 177.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -85.95 -31.9 21.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 120.126 1.33 . . . . 0.0 112.733 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.46 -52.04 44.28 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 124.535 1.134 . . . . 0.0 111.109 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 53.5 mt -49.2 -51.93 52.62 Favored Pre-proline 0 CA--C 1.564 1.482 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 176.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.68 -39.99 1.66 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 124.373 3.382 . . . . 0.0 114.184 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -58.95 -57.16 14.32 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 118.978 0.808 . . . . 0.0 110.876 172.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.483 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.4 mm? -54.57 -34.81 62.51 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.579 -0.7 . . . . 0.0 111.315 175.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.91 90.89 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.115 0.87 . . . . 0.0 112.683 174.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -32.88 67.4 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.266 -0.896 . . . . 0.0 112.445 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.483 HG22 ' HA ' ' A' ' 469' ' ' LEU . 3.8 m -80.68 -26.26 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 175.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.1 tp -56.11 -37.86 69.97 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.767 -1.208 . . . . 0.0 113.374 -175.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -25.45 62.7 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.043 0.537 . . . . 0.0 112.346 178.227 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . 0.403 ' HA ' HG12 ' A' ' 478' ' ' VAL . 0.0 OUTLIER -72.58 -37.3 68.21 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.815 0.846 . . . . 0.0 110.568 172.158 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.706 HG13 ' HB3' ' A' ' 493' ' ' ARG . 79.2 t -68.98 -36.94 76.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 121.217 -0.927 . . . . 0.0 112.099 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -58.2 -52.54 65.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.294 1.037 . . . . 0.0 112.155 170.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 475' ' ' ASN . 7.9 p -79.24 -30.94 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 123.948 0.899 . . . . 0.0 113.161 -170.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 56.6 m -68.42 -23.91 64.68 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 173.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -91.39 -25.64 19.27 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.122 0.969 . . . . 0.0 113.101 169.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 61.8 mtp85 66.27 39.64 4.06 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.306 1.842 . . . . 0.0 112.851 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -134.17 146.27 59.0 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.01 0.924 . . . . 0.0 112.879 -173.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.2 -22.84 21.81 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.055 3.17 . . . . 0.0 113.762 -178.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -141.58 137.56 32.02 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 126.638 1.975 . . . . 0.0 109.196 -178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 53.3 mt -122.15 136.62 54.93 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.341 1.057 . . . . 0.0 109.962 -177.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 3.0 m -91.19 155.92 18.24 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -25.52 2.24 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 174.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -61.04 -47.93 84.13 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.591 1.156 . . . . 0.0 112.058 174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 47.3 t -71.36 -53.49 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 123.573 0.749 . . . . 0.0 110.421 173.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 22.6 t -62.11 -41.33 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.732 -169.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 14.1 t -59.96 -23.6 63.71 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.14 -52.91 5.37 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 120.741 -1.224 . . . . 0.0 112.618 169.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.706 ' HB3' HG13 ' A' ' 476' ' ' VAL . 1.2 mpt_? -70.8 -43.75 68.01 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.331 1.452 . . . . 0.0 112.273 -169.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.443 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.49 -20.35 59.8 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 173.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 21.2 t -84.7 -53.48 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 124.205 1.002 . . . . 0.0 111.696 171.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -89.81 -39.5 13.06 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -169.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -39.32 62.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 56.1 m -67.28 151.18 47.96 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.082 -1.011 . . . . 0.0 112.774 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -60.94 -33.79 73.71 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -106.36 116.97 32.85 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.894 1.278 . . . . 0.0 111.363 176.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -70.66 125.86 28.01 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.345 0.658 . . . . 0.0 110.642 169.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 59.2 tp -117.39 157.56 25.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.274 1.829 . . . . 0.0 111.509 -178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 62.7 m -71.68 150.3 93.33 Favored Pre-proline 0 CA--C 1.548 0.892 0 O-C-N 121.263 -0.898 . . . . 0.0 113.141 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.51 -17.27 38.82 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.979 3.119 . . . . 0.0 114.193 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -74.47 -50.7 9.32 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 123.845 0.736 . . . . 0.0 113.436 176.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -75.43 -24.04 57.03 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.15 -59.35 2.94 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.298 1.439 . . . . 0.0 113.121 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -66.07 -42.32 89.55 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.477 0.58 . . . . 0.0 111.666 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -62.32 -22.76 66.31 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.741 1.616 . . . . 0.0 114.548 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -87.95 -42.13 12.68 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.817 1.247 . . . . 0.0 113.193 169.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 19.8 mt -56.87 -45.56 82.39 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.42 0.688 . . . . 0.0 112.177 175.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.8 -38.14 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.464 0.706 . . . . 0.0 111.638 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.37 -45.29 88.54 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.97 0.908 . . . . 0.0 112.155 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.12 -55.35 21.42 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.438 0.695 . . . . 0.0 112.565 177.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -58.8 -29.48 66.89 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 174.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.78 -31.77 72.62 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.295 1.438 . . . . 0.0 112.343 174.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 26.5 mt -84.54 -35.8 22.59 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.085 0.554 . . . . 0.0 112.251 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.27 112.73 2.27 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 125.246 1.418 . . . . 0.0 111.595 174.67 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.34 10.18 1.91 Allowed 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 124.085 3.19 . . . . 0.0 113.693 173.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -92.33 -45.57 8.13 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.17 1.388 . . . . 0.0 113.91 -169.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.46 ' H ' ' CD2' ' A' ' 518' ' ' LEU . 33.5 t90 -87.03 -48.86 7.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.318 0.647 . . . . 0.0 112.083 171.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 7.0 tt -111.13 132.78 54.01 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.025 0.53 . . . . 0.0 111.977 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 41.8 m -129.69 125.63 36.42 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.341 1.057 . . . . 0.0 111.899 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.8 113.41 23.44 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.778 1.631 . . . . 0.0 109.998 169.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -118.38 152.27 36.16 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.624 1.57 . . . . 0.0 110.657 -179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -115.87 129.56 56.47 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.787 -1.196 . . . . 0.0 109.969 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.9 tp -84.59 -159.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.91 0.884 . . . . 0.0 110.305 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.7 mtm-85 -48.02 -45.31 31.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.383 1.473 . . . . 0.0 114.781 174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 39.7 p -145.56 -22.71 0.47 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.239 1.416 . . . . 0.0 114.189 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.11 172.99 7.88 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.721 2.008 . . . . 0.0 113.472 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 2.7 m -122.24 120.34 33.86 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.519 1.128 . . . . 0.0 111.106 178.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -105.07 153.32 21.65 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.301 1.048 . . . . 0.0 113.701 171.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 39.7 t -116.83 136.8 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.075 1.35 . . . . 0.0 109.371 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -119.07 126.61 52.07 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.326 1.051 . . . . 0.0 110.431 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.32 152.55 50.48 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.37 1.868 . . . . 0.0 112.594 174.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -91.79 108.54 19.99 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.667 -0.645 . . . . 0.0 111.036 171.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 3.3 ptmt -67.68 -18.68 65.02 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -85.23 -3.78 58.94 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.609 1.564 . . . . 0.0 113.589 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.446 ' CG2' HD21 ' A' ' 544' ' ' LEU . 3.5 p -67.27 154.95 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 124.621 1.169 . . . . 0.0 112.163 178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.74 108.15 14.15 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.297 -0.877 . . . . 0.0 109.943 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -51.12 -45.88 61.71 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.113 0.965 . . . . 0.0 112.145 -171.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.85 -27.19 28.38 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -67.08 -44.04 88.92 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.231 0.919 . . . . 0.0 113.834 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.517 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.7 mm? -68.19 -57.83 5.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.824 1.25 . . . . 0.0 110.71 -175.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.66 -29.17 51.78 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.542 -0.724 . . . . 0.0 112.359 173.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.56 53.33 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 120.401 -1.437 . . . . 0.0 114.064 174.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -76.28 -36.69 58.28 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 121.205 -0.935 . . . . 0.0 113.487 178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.65 -27.2 60.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.767 1.227 . . . . 0.0 111.841 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . 0.404 ' HA ' HG22 ' A' ' 552' ' ' VAL . . . -47.28 -23.11 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 175.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.44 -29.37 4.0 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 170.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -82.29 -46.72 13.27 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 549' ' ' ALA . 1.9 m -67.18 -20.25 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 C-N-CA 124.531 1.132 . . . . 0.0 113.851 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -50.44 -16.54 0.36 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.264 1.825 . . . . 0.0 115.098 171.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.07 -37.34 33.08 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 124.557 1.143 . . . . 0.0 113.153 169.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -110.2 -22.28 11.84 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.653 1.581 . . . . 0.0 114.638 169.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 99.66 35.52 4.6 Favored Glycine 0 CA--C 1.539 1.547 0 N-CA-C 117.946 1.938 . . . . 0.0 117.946 169.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 127.651 2.38 . . . . 0.0 112.999 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.895 0 CA-C-O 119.158 -0.801 . . . . 0.0 111.675 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -68.15 127.85 16.58 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 124.067 3.178 . . . . 0.0 111.958 -175.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.254 0.5 OUTLIER 35.08 41.89 0.08 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 128.067 2.547 . . . . 0.0 116.336 178.815 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 64.74 18.88 64.55 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 124.876 1.227 . . . . 0.0 116.055 177.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 8.3 t 121.21 77.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 130.656 3.582 . . . . 0.0 111.079 176.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 14.1 ttt -48.25 133.15 15.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.227 1.411 . . . . 0.0 113.366 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.15 1.33 2.77 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 126.261 1.824 . . . . 0.0 115.266 -174.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -141.28 39.4 1.74 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.41 1.884 . . . . 0.0 112.497 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 41.1 t -138.54 130.41 15.72 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.041 1.336 . . . . 0.0 110.85 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.88 -20.86 64.59 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.443 2.762 . . . . 0.0 114.22 -174.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -33.36 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 170.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.26 -33.94 76.97 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.297 0.639 . . . . 0.0 112.292 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -86.51 -50.55 6.77 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 117.808 -1.091 . . . . 0.0 113.476 177.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.6 pp -55.71 -28.97 58.56 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.538 1.063 . . . . 0.0 112.173 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 8.3 ptm85 -75.56 -35.72 60.57 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.403 1.081 . . . . 0.0 112.804 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.29 -34.14 28.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.177 0.591 . . . . 0.0 111.605 174.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -61.37 -50.72 71.76 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.985 -1.072 . . . . 0.0 110.24 174.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.18 -31.38 71.88 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 120.683 -1.26 . . . . 0.0 113.856 176.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -34.16 74.58 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.136 1.162 . . . . 0.0 114.136 176.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -85.88 -30.79 22.61 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.553 1.069 . . . . 0.0 112.212 174.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -68.69 -52.75 27.62 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 123.9 0.88 . . . . 0.0 111.558 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 48.5 mt -44.76 -52.01 19.92 Favored Pre-proline 0 CA--C 1.564 1.496 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.57 -41.57 0.32 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 124.85 3.7 . . . . 0.0 114.344 176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -58.77 -53.73 55.06 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 119.614 1.097 . . . . 0.0 111.317 175.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.528 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.6 mm? -56.96 -29.88 63.59 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 118.89 -0.576 . . . . 0.0 112.061 174.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.26 69.71 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 119.603 1.092 . . . . 0.0 112.675 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.31 29.69 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 120.939 -1.101 . . . . 0.0 111.426 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 469' ' ' LEU . 2.5 m -88.08 -23.96 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.138 -0.976 . . . . 0.0 113.523 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.6 -41.02 69.45 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.797 1.18 . . . . 0.0 112.687 175.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.63 -35.49 80.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.15 0.58 . . . . 0.0 111.958 175.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -73.93 -37.14 64.68 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.558 1.143 . . . . 0.0 112.348 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 493' ' ' ARG . 41.7 t -65.38 -42.5 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 125.367 1.467 . . . . 0.0 111.469 176.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -57.2 -53.73 54.83 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.76 1.224 . . . . 0.0 112.524 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 7.4 p -76.14 -32.13 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.651 1.18 . . . . 0.0 113.16 -176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 35.0 t -57.31 -35.94 70.47 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.315 0.961 . . . . 0.0 111.914 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -90.77 -8.34 49.98 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 59.56 31.2 20.81 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.379 1.872 . . . . 0.0 114.238 173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -130.52 151.53 78.79 Favored Pre-proline 0 N--CA 1.482 1.133 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -175.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.81 -20.51 15.25 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.91 3.073 . . . . 0.0 114.532 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.34 124.57 15.5 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.292 1.037 . . . . 0.0 110.35 -178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 8.4 mp -112.2 129.53 56.23 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.381 -172.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 8.5 m -76.29 149.54 37.07 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.0 -26.23 0.41 Allowed 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 169.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -67.16 -45.56 76.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.367 1.467 . . . . 0.0 112.365 174.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 37.3 t -67.11 -53.34 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 124.448 1.099 . . . . 0.0 110.519 170.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.54 -44.09 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.033 0.379 . . . . 0.0 110.994 -171.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 13.2 t -62.47 -22.76 66.48 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.69 -48.87 8.44 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 120.219 -1.55 . . . . 0.0 112.709 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.67 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.3 OUTLIER -75.14 -42.7 55.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.077 0.951 . . . . 0.0 112.719 -169.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 13.1 ptm -59.36 -20.51 55.28 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.508 -1.37 . . . . 0.0 113.87 171.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 46.0 t -85.86 -50.52 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 125.234 1.414 . . . . 0.0 112.213 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -90.25 -39.02 13.03 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -172.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.1 t -71.52 -42.62 67.73 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.897 0.879 . . . . 0.0 112.95 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 51.5 t -62.81 141.16 58.74 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.071 -1.018 . . . . 0.0 111.859 169.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -59.72 -28.75 67.61 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 98.6 m -106.19 116.75 32.47 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.957 1.703 . . . . 0.0 111.727 173.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -73.88 106.29 5.53 Favored 'General case' 0 CA--C 1.552 1.052 0 O-C-N 121.03 -1.044 . . . . 0.0 112.463 176.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 39.1 tp -80.82 151.03 28.93 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.242 1.017 . . . . 0.0 112.67 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 41.4 m -65.13 144.45 99.05 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.472 1.109 . . . . 0.0 113.3 174.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -68.64 -21.04 39.85 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.75 2.967 . . . . 0.0 114.25 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.66 -40.61 8.17 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 123.925 0.774 . . . . 0.0 114.041 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.11 -41.37 90.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 117.949 0.875 . . . . 0.0 111.932 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -31.28 66.98 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -67.82 -28.08 67.27 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 121.03 -1.044 . . . . 0.0 113.0 178.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . 0.451 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 10.6 mmpt? -84.55 -32.16 24.0 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.743 1.617 . . . . 0.0 112.957 170.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -78.0 -42.23 33.32 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.497 1.044 . . . . 0.0 113.207 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -54.93 -45.49 74.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.756 0.822 . . . . 0.0 111.628 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.75 -37.66 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.369 0.668 . . . . 0.0 112.068 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.72 74.04 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -57.99 -53.36 59.09 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.473 -0.767 . . . . 0.0 111.438 178.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.29 70.61 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.63 -28.7 70.09 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.593 1.157 . . . . 0.0 114.091 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.56 -35.54 39.65 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -152.83 106.02 2.68 Favored Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.413 1.085 . . . . 0.0 111.93 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -72.46 12.74 0.62 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.051 3.167 . . . . 0.0 114.005 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -108.9 -29.73 8.47 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.826 1.651 . . . . 0.0 113.778 -173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.402 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 26.6 t90 -95.94 -48.67 5.62 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 18.1 tp -109.26 136.13 49.23 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.576 1.151 . . . . 0.0 109.427 169.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 67.7 m -129.69 125.32 35.71 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.775 0.83 . . . . 0.0 111.245 169.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -82.63 113.04 20.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 169.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -111.59 146.44 37.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 111.067 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -128.25 118.2 22.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.692 -1.255 . . . . 0.0 111.185 -174.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 2.0 tp -86.95 -165.7 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.105 0 C-N-CA 124.743 1.217 . . . . 0.0 111.239 -174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -42.29 -45.18 4.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.195 1.798 . . . . 0.0 114.952 174.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 37.4 p -146.6 -22.8 0.42 Allowed 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 177.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -93.85 172.49 8.21 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.193 1.797 . . . . 0.0 113.229 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 9.4 m -122.04 107.69 12.51 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.106 1.363 . . . . 0.0 110.557 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -96.83 138.16 34.81 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 118.996 0.816 . . . . 0.0 111.395 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 2.0 t -117.04 134.27 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 120.713 -1.242 . . . . 0.0 109.649 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -115.16 126.73 54.96 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.005 0.922 . . . . 0.0 110.846 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.402 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.5 tm? -133.62 134.09 42.79 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.708 2.003 . . . . 0.0 111.167 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -87.93 108.43 19.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.699 1.136 . . . . 0.0 110.531 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.15 -12.6 61.26 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -87.27 -5.18 59.03 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.146 1.378 . . . . 0.0 114.225 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.405 ' CG2' HD21 ' A' ' 544' ' ' LEU . 4.4 p -64.45 155.11 6.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 124.673 1.189 . . . . 0.0 112.565 176.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -80.56 109.73 15.36 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.402 -0.811 . . . . 0.0 111.028 170.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -48.06 -46.99 34.05 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.841 1.256 . . . . 0.0 112.319 -175.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -56.61 -23.2 39.32 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -69.17 -45.8 60.42 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.15 0.881 . . . . 0.0 113.681 171.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.565 HD22 ' N ' ' A' ' 544' ' ' LEU . 1.8 mm? -67.81 -57.3 6.52 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.832 1.253 . . . . 0.0 110.875 -174.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 3.6 t -57.48 -18.99 21.44 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.104 0.962 . . . . 0.0 113.567 172.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.56 -40.47 23.04 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 120.509 1.504 . . . . 0.0 114.118 169.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 9.9 ptm85 -86.22 -37.25 18.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -19.27 60.45 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.633 1.173 . . . . 0.0 112.112 175.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -51.47 -22.99 3.48 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 171.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -50.02 -27.49 5.59 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 170.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -80.55 -49.5 11.25 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.38 -23.93 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -175.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -54.53 -17.13 2.87 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.614 1.566 . . . . 0.0 113.906 173.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -52.96 -33.57 51.69 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.384 1.474 . . . . 0.0 113.661 169.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -109.21 -23.62 11.52 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 125.055 1.342 . . . . 0.0 113.537 169.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 95.75 41.19 3.92 Favored Glycine 0 CA--C 1.542 1.773 0 N-CA-C 115.614 1.006 . . . . 0.0 115.614 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 127.425 2.29 . . . . 0.0 114.411 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 CA-C-O 119.349 -0.695 . . . . 0.0 112.052 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -74.8 -175.95 2.58 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 124.552 3.501 . . . . 0.0 113.115 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -139.16 148.77 43.64 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.667 1.987 . . . . 0.0 111.08 177.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 61.85 23.35 63.3 Favored Glycine 0 CA--C 1.542 1.736 0 N-CA-C 116.844 1.497 . . . . 0.0 116.844 175.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 7.8 t 65.16 101.65 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.795 2.038 . . . . 0.0 113.97 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.29 155.97 19.89 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.429 1.492 . . . . 0.0 113.313 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.1 m 72.73 153.85 0.14 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 127.545 2.338 . . . . 0.0 112.095 -171.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 61.85 166.91 0.11 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.23 1.812 . . . . 0.0 113.064 -169.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 91.2 m 62.2 164.81 0.11 Allowed Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 126.563 1.945 . . . . 0.0 115.422 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.28 -23.45 75.3 Favored 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.801 2.334 . . . . 0.0 113.753 175.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.79 -29.52 70.2 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -74.91 -30.03 61.15 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.256 0.934 . . . . 0.0 112.958 174.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -86.65 -48.22 8.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 117.799 -1.096 . . . . 0.0 113.791 178.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.8 pp -57.49 -23.11 48.09 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.747 1.158 . . . . 0.0 113.066 -176.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm85 -77.33 -43.26 33.64 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.787 0.835 . . . . 0.0 111.915 176.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 -33.07 29.3 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.647 0.779 . . . . 0.0 111.647 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -58.3 -53.79 54.27 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.856 0.753 . . . . 0.0 109.038 170.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -51.66 -43.08 62.55 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.372 -0.83 . . . . 0.0 112.66 173.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.532 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.1 OUTLIER -65.74 -36.18 82.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 114.767 1.395 . . . . 0.0 114.767 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.532 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.2 pt-20 -85.82 -28.27 24.58 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 120.278 1.399 . . . . 0.0 112.66 176.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? -75.21 -48.53 23.06 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.289 1.036 . . . . 0.0 112.256 178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 34.5 mt -46.39 -50.63 38.92 Favored Pre-proline 0 CA--C 1.563 1.456 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -74.94 -40.88 0.78 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 124.623 3.549 . . . . 0.0 113.844 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -61.2 -54.52 43.2 Favored 'General case' 0 N--CA 1.483 1.218 0 O-C-N 121.289 -0.882 . . . . 0.0 111.857 175.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.3 mm? -53.5 -34.1 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 123.585 0.754 . . . . 0.0 111.368 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.38 96.66 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.26 0.936 . . . . 0.0 111.989 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -31.2 48.43 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.2 m -81.38 -20.94 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 120.691 -1.256 . . . . 0.0 113.296 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.49 -40.52 87.29 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.03 -1.043 . . . . 0.0 112.613 -169.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.88 -35.06 74.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.717 -179.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -28.52 68.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.95 1.3 . . . . 0.0 110.965 174.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.621 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.9 t -76.8 -44.8 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 O-C-N 121.768 -0.582 . . . . 0.0 111.583 171.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.53 -43.83 98.16 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.081 0.952 . . . . 0.0 112.516 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.33 -32.31 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.981 1.313 . . . . 0.0 113.805 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 64.6 m -67.63 -25.56 65.8 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.645 1.111 . . . . 0.0 113.432 177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -90.7 -16.95 27.6 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.472 1.109 . . . . 0.0 112.979 170.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 64.81 36.5 7.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.066 1.746 . . . . 0.0 112.656 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -134.4 151.42 76.17 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.441 1.096 . . . . 0.0 113.401 -172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.73 -9.44 11.01 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 124.621 3.547 . . . . 0.0 114.833 -178.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -142.21 133.17 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.339 1.856 . . . . 0.0 109.197 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.2 mp -118.15 135.57 54.15 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.275 1.03 . . . . 0.0 109.829 176.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.68 157.95 15.92 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.968 1.307 . . . . 0.0 108.857 -177.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 2.5 ptm -48.59 -25.65 1.84 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 171.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -62.31 -49.14 76.8 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 119.418 1.008 . . . . 0.0 112.231 173.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -70.86 -52.45 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.566 0.746 . . . . 0.0 110.457 174.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.09 -43.44 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.116 -170.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 34.0 t -57.94 -24.63 58.74 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 176.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -86.04 -55.59 3.87 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 121.026 -1.046 . . . . 0.0 112.919 169.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.621 ' HB3' HG13 ' A' ' 476' ' ' VAL . 4.5 mpt_? -69.99 -41.6 74.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.888 1.275 . . . . 0.0 113.701 -169.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . . . . . . . . . 3.3 ppp? -54.5 -23.31 15.85 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 7.7 t -85.93 -55.26 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.944 0.898 . . . . 0.0 112.044 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -92.57 -34.61 13.96 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 9.4 t -73.8 -40.35 63.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 118.748 0.704 . . . . 0.0 112.467 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . . . . . . . . . 57.9 m -68.68 145.68 53.66 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.152 -0.967 . . . . 0.0 112.469 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -32.4 72.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.2 m -106.28 122.2 45.74 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.631 1.572 . . . . 0.0 111.332 170.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 125.45 27.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.926 0.89 . . . . 0.0 111.021 169.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 60.4 tp -117.63 151.05 37.99 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.012 1.725 . . . . 0.0 111.978 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 21.7 m -72.7 145.53 87.2 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.262 1.425 . . . . 0.0 113.202 -176.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -67.95 -18.89 46.59 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.908 3.072 . . . . 0.0 114.202 -179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -69.6 -40.12 77.88 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 123.729 0.681 . . . . 0.0 113.913 174.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -88.26 -24.01 23.35 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.106 0.962 . . . . 0.0 113.54 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -45.91 -55.85 6.2 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.0 1.32 . . . . 0.0 113.234 177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -64.21 -46.88 81.96 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.441 0.696 . . . . 0.0 111.731 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 509' ' ' LYS . 9.4 mmpt? -63.31 -25.29 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.79 1.636 . . . . 0.0 114.112 -177.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -85.37 -40.49 16.43 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.967 1.307 . . . . 0.0 113.122 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 61.2 mt -59.45 -45.02 92.78 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.665 -0.647 . . . . 0.0 111.57 175.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 12.5 p -67.67 -37.99 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.337 0.655 . . . . 0.0 111.653 176.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -43.99 76.25 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.262 1.025 . . . . 0.0 112.928 175.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 37.7 mt -57.7 -54.46 46.66 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 122.04 -0.413 . . . . 0.0 111.611 -179.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.75 71.49 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 172.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.56 -29.3 69.9 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 121.023 -1.048 . . . . 0.0 113.374 176.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 2.6 mp -80.74 -39.55 26.75 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.328 1.051 . . . . 0.0 111.103 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . 0.454 HD22 ' H ' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -155.11 111.59 2.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.261 1.424 . . . . 0.0 111.006 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.83 3.15 5.77 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.377 2.718 . . . . 0.0 113.252 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.14 -46.18 13.06 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.849 1.66 . . . . 0.0 114.447 -169.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.454 ' H ' HD22 ' A' ' 518' ' ' LEU . 36.3 t90 -87.54 -53.26 4.89 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.568 0.747 . . . . 0.0 112.111 171.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 5.3 tt -102.49 132.1 48.75 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.144 0.497 . . . . 0.0 111.374 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 18.6 m -129.73 125.69 36.48 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.952 0.901 . . . . 0.0 111.491 177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -83.06 126.77 32.93 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.688 1.195 . . . . 0.0 109.191 169.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -127.88 150.92 49.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.804 1.241 . . . . 0.0 111.721 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -120.93 122.52 40.38 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.757 -1.215 . . . . 0.0 109.776 -175.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -84.39 -163.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 C-N-CA 123.409 0.684 . . . . 0.0 110.954 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -45.64 -37.88 6.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.044 1.738 . . . . 0.0 115.674 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 14.9 t -155.58 -23.16 0.11 Allowed 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.8 173.78 9.21 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.993 1.717 . . . . 0.0 113.181 173.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 4.2 m -122.9 125.06 44.62 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.956 1.302 . . . . 0.0 110.899 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 25.9 p90 -108.11 156.31 19.44 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.176 0.989 . . . . 0.0 113.345 169.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 40.8 t -117.03 145.67 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.664 1.186 . . . . 0.0 109.106 174.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -127.81 127.03 42.79 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.206 1.003 . . . . 0.0 112.374 175.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 156.06 45.71 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.224 1.81 . . . . 0.0 112.79 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -93.3 108.51 20.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.46 0.704 . . . . 0.0 111.027 170.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -67.61 -17.61 64.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -86.07 -4.15 59.1 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.215 1.406 . . . . 0.0 114.119 -177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 1.2 p -73.28 155.3 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.646 1.178 . . . . 0.0 112.184 -178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -77.58 114.38 16.36 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 121.688 -0.633 . . . . 0.0 110.484 173.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.37 -45.61 76.55 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.931 0.892 . . . . 0.0 111.748 -176.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -55.64 -26.24 43.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.557 1.143 . . . . 0.0 114.027 176.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -73.19 -38.19 54.53 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.267 0.937 . . . . 0.0 113.365 173.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 61.4 mt -69.78 -56.28 7.58 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.956 1.302 . . . . 0.0 112.463 177.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -30.15 68.87 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.293 -0.879 . . . . 0.0 111.904 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -66.16 -37.82 86.59 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -86.28 -35.27 20.04 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -19.24 58.66 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.691 1.196 . . . . 0.0 113.77 177.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -48.28 -22.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.041 1.736 . . . . 0.0 114.91 170.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -49.91 -33.21 16.65 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 171.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.4 m80 -82.77 -34.22 27.15 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 169.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.53 -31.24 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.047 -1.033 . . . . 0.0 112.12 171.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.13 -17.04 2.36 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 170.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -58.55 -32.34 68.8 Favored 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 119.629 1.104 . . . . 0.0 113.569 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -109.19 -23.67 11.51 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 125.259 1.423 . . . . 0.0 113.466 169.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 85.26 68.05 1.39 Allowed Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.225 0.917 . . . . 0.0 114.728 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 127.993 2.517 . . . . 0.0 115.014 -176.197 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 CA-C-O 119.242 -0.754 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.99 7.32 3.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 124.702 3.601 . . . . 0.0 116.554 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . 0.287 1.3 pp 53.49 13.66 0.49 Allowed 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -176.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 174.61 -175.61 46.86 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.826 1.679 . . . . 0.0 112.971 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 33.3 p -57.88 143.88 41.01 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.947 -0.737 . . . . 0.0 112.541 170.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 6.5 ttm -127.28 109.54 11.91 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.525 1.53 . . . . 0.0 110.542 -177.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.2 t -66.31 168.0 9.48 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -108.34 6.67 26.65 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.24 1.816 . . . . 0.0 113.079 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 79.1 m -84.61 150.27 56.21 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.489 1.116 . . . . 0.0 113.607 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.24 -4.44 15.43 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 124.544 3.496 . . . . 0.0 114.595 176.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -80.3 -20.22 44.87 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 171.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.66 -26.39 67.05 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.38 0.672 . . . . 0.0 112.456 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -86.02 -43.55 13.04 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.401 1.081 . . . . 0.0 112.217 175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 52.8 mt -55.98 -23.38 32.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.951 0.9 . . . . 0.0 113.249 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -76.23 -46.65 27.2 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 122.859 0.464 . . . . 0.0 111.5 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.82 -31.13 28.28 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.951 0.9 . . . . 0.0 112.208 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -59.48 -53.92 52.61 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.957 0.799 . . . . 0.0 109.515 173.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 41.9 ttm105 -53.05 -41.71 65.07 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.285 -0.884 . . . . 0.0 112.374 174.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.505 HD23 ' N ' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -67.07 -35.13 79.16 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -179.542 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 463' ' ' LEU . 11.3 pt-20 -85.95 -28.84 24.02 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 120.437 1.472 . . . . 0.0 112.846 175.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 11.2 mmt-85 -71.93 -52.62 16.33 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 124.584 1.154 . . . . 0.0 110.578 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.45 ' HB3' HD11 ' A' ' 548' ' ' LEU . 23.3 mt -44.16 -52.14 16.94 Favored Pre-proline 0 CA--C 1.562 1.44 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -74.18 -39.13 1.75 Allowed 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 124.898 3.732 . . . . 0.0 114.225 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -62.15 -50.92 69.93 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 119.567 1.076 . . . . 0.0 111.545 173.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 472' ' ' VAL . 3.2 mm? -51.15 -33.06 25.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.692 1.197 . . . . 0.0 112.05 170.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -67.29 -32.89 74.19 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.275 -0.89 . . . . 0.0 113.077 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -32.1 22.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.204 -0.935 . . . . 0.0 112.951 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 469' ' ' LEU . 4.8 m -84.25 -26.13 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 O-C-N 121.062 -1.024 . . . . 0.0 113.645 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.71 -36.96 70.28 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 120.191 1.36 . . . . 0.0 112.781 175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.2 -44.8 83.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.673 1.189 . . . . 0.0 111.134 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -69.84 -37.01 76.04 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.618 0.767 . . . . 0.0 112.476 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 493' ' ' ARG . 53.1 t -62.41 -43.51 98.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 O-C-N 121.082 -1.011 . . . . 0.0 111.674 175.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -62.3 -45.78 91.71 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.848 0.859 . . . . 0.0 112.708 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.4 p -76.72 -31.51 19.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.142 1.377 . . . . 0.0 113.648 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 23.1 t -59.46 -28.46 67.02 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 120.889 -1.132 . . . . 0.0 112.838 174.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -90.75 -17.04 27.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.749 1.22 . . . . 0.0 113.73 173.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 52.45 44.83 29.54 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.532 1.533 . . . . 0.0 113.474 -172.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -135.51 147.94 63.79 Favored Pre-proline 0 CA--C 1.549 0.904 0 O-C-N 121.11 -0.994 . . . . 0.0 113.31 -178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -81.7 -10.5 11.83 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 124.504 3.469 . . . . 0.0 114.017 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -143.32 130.6 20.91 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.835 1.654 . . . . 0.0 109.764 169.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 10.5 mp -113.51 132.62 55.61 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.64 1.176 . . . . 0.0 108.768 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 1.2 m -78.17 149.79 33.68 Favored 'General case' 0 CA--C 1.52 -0.177 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.5 -27.37 0.45 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 175.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -66.25 -48.85 69.15 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.682 1.193 . . . . 0.0 111.637 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.6 t -66.02 -51.91 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 123.8 0.84 . . . . 0.0 110.668 172.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.79 -46.9 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.147 0.43 . . . . 0.0 110.72 -169.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 61.4 m -57.73 -53.04 62.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.588 0.755 . . . . 0.0 112.688 171.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.19 86.41 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.804 -1.185 . . . . 0.0 113.591 -175.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.664 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.0 OUTLIER -83.16 -39.93 20.39 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 124.673 1.189 . . . . 0.0 111.092 -176.577 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.46 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.0 OUTLIER -60.8 -20.9 62.46 Favored 'General case' 0 CA--C 1.549 0.908 0 O-C-N 121.227 -0.921 . . . . 0.0 113.465 169.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 65.9 t -85.57 -50.59 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.804 1.242 . . . . 0.0 111.964 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -92.67 -41.33 10.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 -170.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 7.9 t -74.6 -34.66 62.9 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 33.4 m -69.12 148.3 50.17 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.107 -0.996 . . . . 0.0 112.168 172.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 24.6 pt20 -61.44 -31.17 71.11 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.5 m -106.38 127.41 53.25 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.921 1.289 . . . . 0.0 111.809 172.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -85.61 123.4 30.98 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.689 1.196 . . . . 0.0 111.095 171.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 32.0 tp -93.69 154.34 17.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.811 1.244 . . . . 0.0 112.615 176.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 20.0 m -59.52 147.16 77.91 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 125.162 1.385 . . . . 0.0 113.526 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.98 -20.59 33.58 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.675 2.917 . . . . 0.0 114.761 -175.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -84.23 -38.06 10.46 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 121.833 -0.542 . . . . 0.0 113.179 173.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -72.31 -39.62 68.1 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.374 1.07 . . . . 0.0 112.71 177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -54.71 -42.36 71.41 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -58.69 -47.31 84.95 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 121.2 -0.938 . . . . 0.0 112.188 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -68.59 -31.58 70.87 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.356 1.862 . . . . 0.0 113.21 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -78.79 -39.98 34.35 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.434 1.494 . . . . 0.0 112.794 178.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.66 -43.08 99.54 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.898 0.879 . . . . 0.0 111.994 175.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 11.0 p -69.08 -35.8 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 121.694 -0.628 . . . . 0.0 112.532 172.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 517' ' ' LEU . 0.2 OUTLIER -52.08 -39.21 59.38 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 -175.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -60.08 -57.06 14.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.785 0.72 . . . . 0.0 111.072 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . . . . . . . . . . . -59.81 -32.36 70.57 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 121.187 -0.945 . . . . 0.0 112.84 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.02 -25.17 66.94 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.177 1.391 . . . . 0.0 114.01 175.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . 0.414 HD13 HD23 ' A' ' 513' ' ' LEU . 4.9 mp -94.64 -35.8 12.04 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.681 1.193 . . . . 0.0 111.904 175.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -153.37 107.81 2.59 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 124.772 1.229 . . . . 0.0 111.659 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.88 3.74 2.65 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 123.229 2.619 . . . . 0.0 113.43 172.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.99 -24.56 40.8 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.286 1.835 . . . . 0.0 114.3 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' A' ' 535' ' ' LEU . 28.5 t90 -115.11 -47.67 2.85 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.204 1.002 . . . . 0.0 113.391 -178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.4 137.85 44.7 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.453 1.101 . . . . 0.0 109.601 169.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 32.2 m -129.63 125.24 35.63 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.927 0.891 . . . . 0.0 110.434 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.63 113.34 20.26 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.882 1.273 . . . . 0.0 108.863 170.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 152.75 30.89 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.535 . . . . 0.0 112.23 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -128.33 124.71 37.15 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.547 -1.345 . . . . 0.0 111.894 -177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . . . . . . . . . 1.2 tp -84.86 -164.6 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 124.541 1.136 . . . . 0.0 110.993 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -44.48 -44.99 8.95 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.867 1.667 . . . . 0.0 114.861 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 41.1 p -146.07 -22.76 0.45 Allowed 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -87.24 173.2 9.35 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.758 1.623 . . . . 0.0 113.453 173.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 11.6 m -123.09 117.66 25.93 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.481 1.512 . . . . 0.0 110.713 178.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -113.47 147.96 36.87 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.244 1.018 . . . . 0.0 113.012 175.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -114.76 147.69 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 120.951 -1.093 . . . . 0.0 110.713 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . . . . . . . . . 67.8 tttt -125.49 126.68 45.27 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.955 0.902 . . . . 0.0 110.375 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 2.1 tm? -134.54 133.82 40.72 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.221 1.809 . . . . 0.0 111.235 -173.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -82.1 108.03 15.26 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.937 1.244 . . . . 0.0 110.701 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -11.74 60.28 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.122 1.369 . . . . 0.0 113.499 175.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -95.01 -3.26 48.7 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.376 1.47 . . . . 0.0 114.252 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.15 155.26 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.477 1.111 . . . . 0.0 112.504 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -82.73 120.32 25.45 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.365 0.666 . . . . 0.0 110.488 169.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.34 -46.49 66.1 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.992 0.917 . . . . 0.0 111.86 177.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -58.26 -22.01 50.78 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -77.4 -41.95 19.6 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 123.846 0.736 . . . . 0.0 113.152 170.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 74.8 mt -61.22 -57.98 10.19 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.917 1.287 . . . . 0.0 112.548 177.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 2.1 t -60.54 -19.09 56.2 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.873 -1.142 . . . . 0.0 112.905 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -81.12 -38.07 27.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.568 -1.332 . . . . 0.0 113.866 174.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -85.51 -31.39 22.77 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.45 HD11 ' HB3' ' A' ' 466' ' ' LEU . 0.1 OUTLIER -78.81 -18.92 53.3 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.216 1.406 . . . . 0.0 112.439 176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -44.55 -23.48 0.12 Allowed 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 116.66 2.096 . . . . 0.0 116.66 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -49.17 -34.81 15.27 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 170.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -82.52 -40.62 20.76 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 74.6 t -54.0 -30.12 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.593 1.157 . . . . 0.0 112.9 171.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -59.45 -17.14 28.64 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.54 68.16 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 175.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.53 -23.52 11.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.167 1.387 . . . . 0.0 112.887 169.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 92.97 54.27 1.78 Allowed Glycine 0 CA--C 1.537 1.406 0 C-N-CA 124.325 0.964 . . . . 0.0 114.565 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 C--O 1.251 1.16 0 C-N-CA 126.416 1.887 . . . . 0.0 112.701 -173.172 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.95 0 CA-C-O 119.751 -0.472 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.34 177.29 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.408 3.405 . . . . 0.0 112.656 175.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -62.24 -5.62 2.5 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -179.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -171.85 -56.88 0.04 OUTLIER Glycine 0 CA--C 1.534 1.27 0 O-C-N 121.118 -0.989 . . . . 0.0 114.47 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 67.6 m -147.87 -53.69 0.2 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.451 1.1 . . . . 0.0 112.508 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 5.8 tpt 55.44 166.16 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.366 2.266 . . . . 0.0 115.706 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 35.6 p -90.16 154.22 19.92 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.894 1.278 . . . . 0.0 111.774 170.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? 44.74 45.64 8.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.829 1.652 . . . . 0.0 115.038 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' CYS . . . . . . . . . . . . . 6.9 m -121.91 67.58 23.51 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.773 1.629 . . . . 0.0 112.14 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -64.08 -7.91 14.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 123.667 2.911 . . . . 0.0 114.445 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.89 -21.17 61.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -25.93 68.53 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.03 0.932 . . . . 0.0 112.071 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' GLU . . . . . 0.509 ' HB2' HE21 ' A' ' 461' ' ' GLN . 4.1 pt-20 -85.89 -40.81 15.54 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 118.387 -0.816 . . . . 0.0 112.208 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 48.5 mt -55.24 -21.89 15.91 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -83.77 -38.63 21.06 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 177.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.47 -34.39 25.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' GLN . . . . . 0.509 HE21 ' HB2' ' A' ' 457' ' ' GLU . 32.9 mm-40 -63.44 -46.26 87.11 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.316 -1.49 . . . . 0.0 110.394 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -55.67 -33.47 64.13 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.775 -1.203 . . . . 0.0 113.113 174.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -31.67 72.74 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 176.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -32.21 21.74 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 120.116 1.326 . . . . 0.0 111.979 172.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 52.4 mmt-85 -63.09 -51.34 66.97 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 125.108 1.363 . . . . 0.0 111.117 177.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 22.6 mt -51.17 -54.35 39.04 Favored Pre-proline 0 CA--C 1.561 1.381 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 177.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.02 -38.08 4.26 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 124.863 3.709 . . . . 0.0 113.861 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -58.66 -56.43 22.23 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.531 -0.73 . . . . 0.0 110.807 169.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . 0.537 ' HA ' HG22 ' A' ' 472' ' ' VAL . 4.0 mm? -53.16 -34.21 55.89 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.653 -0.654 . . . . 0.0 111.549 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' ALA . . . . . . . . . . . . . . . -62.48 -44.78 95.55 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 175.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -72.95 -39.89 65.82 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.769 -1.207 . . . . 0.0 111.83 178.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 469' ' ' LEU . 5.9 m -78.51 -21.74 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 121.653 -0.654 . . . . 0.0 112.238 -173.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.17 -34.29 63.7 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.199 0.999 . . . . 0.0 113.308 174.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -61.27 -44.58 97.01 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.766 0.826 . . . . 0.0 111.314 170.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -65.5 -30.55 71.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.96 0.904 . . . . 0.0 112.943 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . 0.74 HG13 ' HB3' ' A' ' 493' ' ' ARG . 71.6 t -73.59 -42.85 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.155 -0.966 . . . . 0.0 111.835 173.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.36 -50.69 72.16 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.075 0.95 . . . . 0.0 111.86 174.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 9.0 p -79.41 -27.62 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.483 1.113 . . . . 0.0 113.193 -171.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.9 -31.54 72.63 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 120.925 -1.11 . . . . 0.0 112.031 170.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -91.08 -26.45 19.14 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.414 1.264 . . . . 0.0 114.414 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 53.64 49.65 18.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.329 1.852 . . . . 0.0 113.604 -169.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -137.21 146.72 55.43 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 123.757 0.823 . . . . 0.0 111.995 177.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -72.83 -20.71 22.21 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 123.613 2.875 . . . . 0.0 113.606 176.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' ALA . . . . . . . . . . . . . . . -137.75 124.93 21.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.94 1.696 . . . . 0.0 109.552 -174.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 9.1 mp -125.72 140.69 52.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.886 1.674 . . . . 0.0 109.095 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.19 159.07 16.25 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.107 0.963 . . . . 0.0 109.613 174.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.17 -27.15 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 169.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.98 -43.89 77.89 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.932 0.893 . . . . 0.0 112.51 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.1 t -70.55 -51.24 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 122.935 0.494 . . . . 0.0 110.271 169.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.93 -40.85 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 118.731 -0.652 . . . . 0.0 111.394 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' CYS . . . . . . . . . . . . . 24.4 t -62.08 -22.14 65.54 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 120.168 1.349 . . . . 0.0 114.351 174.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -85.87 -49.8 7.61 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.293 -1.504 . . . . 0.0 111.477 169.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' ARG . . . . . 0.74 ' HB3' HG13 ' A' ' 476' ' ' VAL . 0.6 OUTLIER -76.31 -46.93 25.47 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 124.571 1.149 . . . . 0.0 112.676 -169.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' MET . . . . . 0.459 ' HA ' ' SG ' ' A' ' 498' ' ' CYS . 0.8 OUTLIER -60.71 -22.29 63.8 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.471 -1.393 . . . . 0.0 113.787 174.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' VAL . . . . . . . . . . . . . 98.2 t -85.81 -50.01 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 123.95 0.9 . . . . 0.0 111.628 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -93.09 -39.22 11.19 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.284 1.957 . . . . 0.0 116.284 -177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' SER . . . . . . . . . . . . . 8.5 t -69.69 -39.07 77.18 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.3 0.954 . . . . 0.0 112.56 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 494' ' ' MET . 31.1 m -70.54 145.54 50.77 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.111 -0.993 . . . . 0.0 112.478 173.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -61.78 -32.41 72.68 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.3 m -106.37 117.79 34.97 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.27 1.428 . . . . 0.0 111.292 172.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' ALA . . . . . . . . . . . . . . . -71.81 128.95 37.41 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.841 0.856 . . . . 0.0 110.968 169.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.06 150.89 35.2 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.998 1.719 . . . . 0.0 112.22 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 144.48 92.1 Favored Pre-proline 0 CA--C 1.55 0.961 0 O-C-N 121.357 -0.839 . . . . 0.0 113.042 174.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.03 -26.84 58.02 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.88 3.053 . . . . 0.0 114.684 -176.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' GLY . . . . . . . . . . . . . . . -65.81 -41.26 95.73 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 123.661 0.648 . . . . 0.0 113.638 178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -78.22 -39.72 39.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.069 0.948 . . . . 0.0 112.342 172.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' MET . . . . . . . . . . . . . 16.4 ttp -48.68 -53.13 19.93 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.252 1.021 . . . . 0.0 112.205 178.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -58.2 -44.63 88.18 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.443 0.697 . . . . 0.0 112.287 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -67.05 -34.23 77.23 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.325 1.45 . . . . 0.0 113.536 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 14.9 m170 -73.9 -41.33 62.29 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.579 -1.326 . . . . 0.0 112.679 177.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.09 -44.51 83.24 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.784 0.834 . . . . 0.0 111.533 174.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.16 -41.92 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.294 0.637 . . . . 0.0 112.236 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 8.9 tt -64.97 -34.12 77.67 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -176.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 15.8 mt -53.68 -57.84 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.052 -1.03 . . . . 0.0 112.55 171.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' ALA . . . . . 0.401 ' HB3' HD21 ' A' ' 524' ' ' LEU . . . -62.66 -27.15 69.03 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 175.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.58 -29.61 70.84 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.398 1.079 . . . . 0.0 113.805 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -79.16 -39.52 33.25 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.911 0.778 . . . . 0.0 112.581 170.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' LEU . . . . . 0.541 HD21 ' HB3' ' A' ' 521' ' ' TRP . 0.0 OUTLIER -148.66 104.48 3.45 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.538 1.135 . . . . 0.0 111.21 -178.422 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.6 2.46 5.19 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.412 2.741 . . . . 0.0 113.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -84.12 -56.64 3.55 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.939 1.696 . . . . 0.0 112.736 -169.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' TRP . . . . . 0.541 ' HB3' HD21 ' A' ' 518' ' ' LEU . 26.7 t90 -77.77 -54.18 6.65 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 176.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 533' ' ' VAL . 41.6 tp -98.14 133.41 42.61 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.217 0.532 . . . . 0.0 110.169 171.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' SER . . . . . . . . . . . . . 15.4 m -129.8 125.85 36.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.501 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' LEU . . . . . 0.401 HD21 ' HB3' ' A' ' 515' ' ' ALA . 0.2 OUTLIER -82.09 137.54 35.0 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 171.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -132.28 152.74 51.23 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.715 1.206 . . . . 0.0 111.514 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' ARG . . . . . . . . . . . . . 11.5 tpp85 -128.1 124.67 37.53 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.917 -1.114 . . . . 0.0 110.221 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 530' ' ' ASP . 0.9 OUTLIER -84.38 -166.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 123.829 0.852 . . . . 0.0 110.263 175.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -43.67 -45.23 6.87 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 23.4 p -142.35 -21.81 0.68 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.736 1.615 . . . . 0.0 114.636 -174.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' ASP . . . . . 0.405 ' H ' HG22 ' A' ' 527' ' ' ILE . 1.9 m-20 -111.58 168.79 9.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.128 2.171 . . . . 0.0 111.574 -174.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' THR . . . . . . . . . . . . . 7.3 m -121.16 112.65 18.93 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.928 0.891 . . . . 0.0 110.793 -171.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -104.8 140.34 38.25 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.175 0.59 . . . . 0.0 111.936 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' VAL . . . . . 0.602 HG22 HD11 ' A' ' 522' ' ' LEU . 12.6 p -116.51 134.04 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 121.001 -1.062 . . . . 0.0 110.833 -176.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' LYS . . . . . 0.478 ' O ' HD12 ' A' ' 522' ' ' LEU . 14.8 ttpt -115.22 126.22 54.29 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.468 0.707 . . . . 0.0 111.729 -173.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.406 HD21 ' CZ2' ' A' ' 521' ' ' TRP . 3.2 tm? -135.01 132.01 37.79 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.476 1.91 . . . . 0.0 111.129 -171.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -89.54 108.22 19.53 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 118.867 0.758 . . . . 0.0 110.495 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.27 -19.01 62.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' ALA . . . . . . . . . . . . . . . -91.7 -1.74 57.29 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.609 1.564 . . . . 0.0 113.593 -169.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.429 ' CG2' HD21 ' A' ' 544' ' ' LEU . 2.8 p -63.67 155.03 6.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.472 1.109 . . . . 0.0 111.919 175.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -77.92 102.41 7.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.075 -1.015 . . . . 0.0 110.445 172.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.3 -45.55 35.04 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.832 1.253 . . . . 0.0 112.671 -169.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' ALA . . . . . . . . . . . . . . . -53.83 -29.39 40.7 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' GLY . . . . . . . . . . . . . . . -64.89 -39.49 96.57 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 125.127 1.346 . . . . 0.0 113.649 172.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 544' ' ' LEU . 2.1 mm? -77.83 -54.5 6.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.572 1.549 . . . . 0.0 110.493 -173.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' THR . . . . . . . . . . . . . 1.2 t -57.38 -26.48 61.12 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 119.019 -0.515 . . . . 0.0 112.126 174.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -70.66 -36.87 73.6 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.39 -39.7 16.14 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.41 1.084 . . . . 0.0 113.393 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 13.8 tp -66.82 -25.39 66.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.817 1.647 . . . . 0.0 112.977 175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' ALA . . . . . . . . . . . . . . . -45.39 -23.45 0.21 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 170.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -51.45 -31.95 25.07 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 172.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -82.46 -45.4 14.8 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 172.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.2 -27.72 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 124.183 0.993 . . . . 0.0 112.842 -176.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 -52.54 -17.37 1.22 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.296 2.238 . . . . 0.0 114.384 171.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -50.7 -36.66 37.17 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -109.28 -23.62 11.5 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.754 1.222 . . . . 0.0 113.776 169.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' GLY . . . . . . . . . . . . . . . 89.66 52.98 2.52 Favored Glycine 0 CA--C 1.54 1.628 0 N-CA-C 116.287 1.275 . . . . 0.0 116.287 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.252 1.189 0 C-N-CA 127.524 2.329 . . . . 0.0 115.019 -170.617 . . . . . . . . 0 0 . 1 stop_ save_