data_2mpf_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 2mpf _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 ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 116.017 1.858 . . . . 4.46 116.017 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 7.11 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.93 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 4.83 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 2.32 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 3.07 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.59 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 4.01 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.9 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 3.64 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 4.08 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 4.57 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 2.34 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.49 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 4.1 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 2.39 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 2.43 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 2.19 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 2.13 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 2.47 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 2.58 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 3.16 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 3.7 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 2.43 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 4.3 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 2.31 111.793 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 3.71 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.61 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 4.42 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 2.19 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 3.15 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 10.76 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 4.08 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 4.64 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 2.08 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 5.2 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 5.55 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.66 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 3.62 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 4.1 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 2.17 111.885 -159.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 3.61 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.89 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 2.22 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 2.23 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.49 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 3.36 107.743 -140.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 3.4 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.85 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.98 114.664 -169.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.93 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 6.33 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 3.61 110.739 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 3.93 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 2.71 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 2.16 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.61 113.502 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 7.18 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 3.57 113.835 175.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 8.9 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 6.75 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.76 113.349 174.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 5.98 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 5.58 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 7.81 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.88 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 4.51 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 6.83 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 4.48 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 3.03 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.73 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 2.49 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 6.2 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 2.01 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.95 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 5.21 106.921 164.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 2.84 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 4.27 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 2.08 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.9 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 3.16 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 3.47 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.2 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 3.74 110.89 -174.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 4.15 109.322 161.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 2.01 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 3.65 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 3.76 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.62 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 3.83 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 3.25 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 4.73 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 6.32 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 3.44 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 5.0 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 5.5 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.68 112.493 176.148 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 114.661 1.356 . . . . 4.53 114.661 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 4.73 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.97 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 3.49 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.82 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 2.08 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 3.23 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 2.13 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 3.28 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 3.43 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 2.3 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.84 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 1.92 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.13 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 2.47 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 3.09 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 2.22 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 1.77 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 1.71 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 1.68 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 1.95 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 2.37 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 3.44 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 3.27 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 2.53 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 3.75 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.41 HG12 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 1.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . 0.421 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 3.06 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.96 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 3.52 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . 0.421 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 1.89 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 2.26 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 8.25 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.92 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 4.3 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.56 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 5.05 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 4.11 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 2.48 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 3.62 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 4.08 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 1.73 110.336 -166.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 3.76 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.9 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 1.68 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 1.61 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.17 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 3.53 107.628 -142.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 2.41 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.64 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.5 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.75 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.488 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.488 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 5.72 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 2.39 111.825 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 2.87 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 1.96 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 2.13 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.21 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.97 111.862 172.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 4.59 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 3.72 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.68 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 8.23 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . 0.423 HD21 ' CD2' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 4.12 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 5.23 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 4.03 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 7.14 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.85 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.73 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 11.71 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.1 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.89 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 4.22 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 2.03 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.81 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 1.86 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 2.09 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.41 ' CE1' HG12 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 4.45 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 3.32 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 5.24 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 1.9 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 8.23 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.37 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 2.57 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.25 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 2.9 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . 0.423 ' CD2' HD21 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 3.7 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 1.74 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 3.84 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 3.46 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.72 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 2.68 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 2.44 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 6.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 7.65 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.3 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 3.87 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.26 111.755 176.542 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 8.88 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 8.01 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 3.18 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 2.12 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.83 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.67 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.8 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.74 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 3.4 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 3.65 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 2.58 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 3.13 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.86 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.55 113.962 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 2.6 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 3.97 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 3.81 112.498 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 2.02 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 1.73 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.91 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 1.97 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 2.93 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 3.34 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.495 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 3.31 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . 0.495 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.65 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 3.57 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 1.82 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 3.86 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.33 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 4.68 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 2.64 112.737 -173.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 3.92 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 10.2 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 5.03 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.29 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 3.14 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 3.57 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 2.18 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 5.6 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 7.31 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.93 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 3.84 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 4.54 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 2.02 109.639 -155.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 3.52 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 2.53 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 2.23 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 3.63 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 3.02 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 3.49 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.82 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 5.15 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 5.55 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 3.24 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 3.06 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 2.29 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.69 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.78 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.41 111.963 170.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 5.29 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 4.48 110.36 176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.99 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 6.21 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 6.11 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 4.15 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 4.68 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.76 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.85 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.71 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 6.2 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 8.31 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.95 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 3.64 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 2.75 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 1.8 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 6.09 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 1.77 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.84 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 4.18 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 3.05 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 3.59 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 2.4 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.2 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 3.54 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 2.59 106.236 174.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 3.43 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 3.87 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 2.15 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 3.19 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 4.04 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.67 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 2.47 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 3.2 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 7.72 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 6.62 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 2.19 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 3.29 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.68 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.96 111.201 -174.119 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.546 0.824 0 N-CA-C 114.914 1.45 . . . . 3.78 114.914 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 4.45 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 5.42 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 4.58 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 2.33 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.8 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 5.14 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 3.06 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.46 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 3.79 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 4.16 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 3.42 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 3.3 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 2.42 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.92 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.92 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 3.3 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 3.02 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 2.11 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 1.76 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.78 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 2.36 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.46 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.95 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 561' ' ' LYS . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 3.28 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . 0.433 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 2.55 112.611 -173.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 4.37 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.42 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 2.08 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 3.34 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.77 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.27 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 3.66 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.92 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 2.65 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 9.2 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.2 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.96 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 4.07 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.55 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.77 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 4.02 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 3.03 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 4.08 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 4.42 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 1.98 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 3.61 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 1.01 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 1.74 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 1.78 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 3.74 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 3.21 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.51 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.81 110.287 172.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 7.03 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 5.8 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 3.65 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 2.56 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 2.31 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 2.25 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.38 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 4.64 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 3.64 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.9 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 7.31 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 4.2 115.96 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.91 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 3.59 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 9.38 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 4.52 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 4.68 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 7.16 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 5.03 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 3.26 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.36 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 2.04 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 4.27 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 1.59 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 1.77 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.42 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 4.48 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 3.15 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 3.39 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 1.84 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 7.41 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.65 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 2.28 110.438 -170.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 3.07 111.28 -172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 3.67 111.468 175.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 2.16 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 3.1 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 3.6 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 2.38 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 3.58 110.787 -177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 5.45 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 7.02 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 3.07 112.961 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 3.84 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.08 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.64 112.622 178.381 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 4.24 116.899 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 6.44 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 6.98 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 3.19 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.98 111.097 172.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 2.14 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 3.37 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.67 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.97 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 4.35 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 3.68 112.337 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 2.48 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 3.42 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 2.14 114.466 -168.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.58 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 3.51 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 3.7 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 2.59 112.134 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 2.97 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 2.17 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 1.84 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 2.39 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 3.91 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 3.51 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 3.57 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 3.64 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 3.23 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . 0.408 ' CD ' ' HG ' ' A' ' 632' ' ' SER . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 1.9 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 3.39 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.92 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 3.72 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.83 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 2.46 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 8.3 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 3.48 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.84 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.84 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 8.44 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 4.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.53 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 4.44 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 4.06 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 1.91 111.463 -169.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 3.04 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.98 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 1.95 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 1.84 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.42 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 3.59 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 3.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.75 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 5.13 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 4.22 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 4.28 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.32 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 3.05 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 3.25 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 1.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 2.0 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.23 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.97 112.392 174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 4.97 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 3.7 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 6.54 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 6.46 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 3.21 115.331 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 5.18 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 4.01 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 8.6 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 2.19 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 4.26 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 7.25 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 4.19 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 2.56 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.86 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 1.97 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 5.43 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 1.64 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 1.85 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 4.47 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.99 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 4.83 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 2.14 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.66 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 632' ' ' SER . . . . . 0.408 ' HG ' ' CD ' ' A' ' 563' ' ' GLU . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 2.61 113.364 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 2.36 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 3.88 110.902 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 4.32 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.89 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.96 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 3.72 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.85 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 2.57 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 3.1 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 5.52 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 6.54 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 2.26 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 3.82 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 3.06 113.068 -179.051 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 121.245 0.545 . . . . 7.99 112.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 7.07 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.93 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 4.17 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 2.09 111.43 177.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 2.13 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.88 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 2.12 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 3.33 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 3.51 113.448 175.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 2.32 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 3.25 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 2.09 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.2 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.74 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 3.41 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 2.43 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 1.67 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 1.78 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.86 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 1.95 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 2.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 3.79 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 3.66 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 4.69 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 3.96 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.49 HG12 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 2.19 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 3.75 111.316 167.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 3.53 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 2.59 113.119 -169.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 3.28 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 8.09 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 4.03 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 3.6 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 3.2 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.96 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 5.36 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.89 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 2.86 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 4.21 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 3.67 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 1.81 110.699 -164.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.7 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.11 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 2.31 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 1.74 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 3.65 108.582 -138.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 3.65 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.73 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 6.77 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.75 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.471 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.471 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 4.56 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 2.57 112.14 -169.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 3.21 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 1.96 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 4.53 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 1.07 112.688 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 4.55 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 3.58 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 9.11 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 6.11 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.7 114.005 -163.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 6.53 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 4.51 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.82 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.5 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 4.3 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 7.16 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 5.46 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 2.78 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.57 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 2.16 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 5.13 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.87 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 2.03 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG12 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 5.39 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 3.52 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 5.46 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.59 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.56 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 3.13 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 2.34 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 3.86 111.007 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.61 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 3.89 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 2.04 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 3.04 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 3.67 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.37 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 2.69 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 2.47 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 5.56 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 6.64 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 2.2 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 3.81 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 4.03 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 3.34 111.202 174.569 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 5.22 114.64 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.97 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.83 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 3.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 2.18 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 2.1 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 3.25 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 3.38 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.41 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.84 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 3.54 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 2.6 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 3.19 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 2.09 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.31 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 4.25 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 3.6 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 2.56 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 2.21 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 1.97 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 2.04 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 2.07 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 4.35 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.79 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 3.47 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 3.67 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 4.02 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 2.14 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 3.58 111.139 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 4.34 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.42 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 3.96 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 2.03 114.683 -163.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 2.66 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 8.48 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.94 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 5.44 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 3.7 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.51 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 5.44 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 4.18 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 2.68 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 4.59 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 3.77 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.93 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 5.79 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.16 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 1.98 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 2.09 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.61 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 3.96 108.616 -137.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 3.25 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.82 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 4.57 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.59 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.53 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.53 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 5.25 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.94 113.075 -167.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.92 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 3.25 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.94 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.13 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 4.42 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 3.31 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.38 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 6.71 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.43 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 3.58 113.103 -162.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 4.73 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 4.69 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 13.43 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 5.29 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 4.31 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.96 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 6.1 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 3.15 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.78 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 2.15 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 5.45 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 2.19 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 2.14 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 5.51 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 3.7 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 5.21 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 2.01 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 7.32 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 2.17 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 2.61 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 2.75 112.092 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 3.82 111.98 163.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 2.12 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 3.84 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 3.42 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.73 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 3.24 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 2.94 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 6.93 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 6.77 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.19 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.34 111.644 179.878 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.76 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 7.78 113.887 167.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 3.59 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 2.27 110.703 173.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 2.77 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.81 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 2.18 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 3.73 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 4.0 112.999 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 2.24 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 3.31 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 2.11 114.057 -170.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.38 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 2.55 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 3.14 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 2.59 111.691 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 3.02 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 2.19 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.84 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 2.71 114.06 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 3.37 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 4.28 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 3.78 112.064 -167.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.9 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 4.12 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 1.98 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 3.55 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 3.83 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 2.18 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 2.26 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 8.82 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 3.21 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 4.3 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 2.09 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 4.6 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 5.53 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 3.77 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 4.37 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 3.8 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 1.82 111.284 -161.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.92 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 5.36 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 1.17 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 2.09 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 1.96 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.59 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 4.3 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 2.85 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 4.25 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 7.03 117.7 -162.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 5.25 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.49 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 4.24 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 3.1 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 3.71 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 1.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 2.19 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.29 111.429 170.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 6.81 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 3.79 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 6.44 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 6.61 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.99 112.946 -167.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . 0.426 ' H ' HD11 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 4.17 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 3.37 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 8.02 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.7 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 6.27 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 6.49 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.91 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 2.33 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 2.5 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 2.26 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 4.36 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 2.13 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 2.25 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 4.66 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 3.59 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 3.5 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.92 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 8.12 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.61 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 2.25 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 3.74 112.19 -174.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 3.52 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.95 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.94 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 3.61 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.62 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 2.61 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 2.65 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 5.27 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 6.07 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 2.46 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 3.3 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.71 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 3.28 112.137 174.987 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 112.583 0.586 . . . . 3.56 112.583 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 6.59 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 4.37 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 3.42 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 2.63 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.84 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.78 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.76 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.77 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 3.82 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 3.77 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 2.81 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . 0.422 ' ND2' ' H ' ' A' ' 547' ' ' ASN . 5.1 p30 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 5.42 113.705 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 2.5 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.37 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 3.46 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 3.61 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 3.22 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 2.25 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 1.72 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 3.24 115.459 174.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 2.67 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 2.75 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 3.48 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 3.46 114.135 -159.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 2.71 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 4.29 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 3.1 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.502 HG12 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 1.89 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 3.55 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.24 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 4.02 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 2.55 115.626 -167.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.62 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 11.81 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.67 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.98 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 4.98 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 3.35 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 2.24 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.87 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 4.05 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 2.98 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 3.61 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 3.72 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 1.92 111.575 -164.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.87 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 3.46 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 2.14 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 2.03 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.81 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 4.17 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 2.47 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 3.17 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 5.18 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 4.72 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.94 112.125 177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 3.27 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.81 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 2.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.9 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.17 111.551 167.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 4.17 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 3.76 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 8.3 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 7.35 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . 0.469 HD23 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 3.49 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 4.44 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.99 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 11.72 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 3.08 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 5.23 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 5.92 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 4.2 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 2.61 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.95 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.97 114.437 -172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 5.42 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 1.8 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.85 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.502 ' CE1' HG12 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 5.33 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 3.31 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 5.73 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 1.79 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.68 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 2.39 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 2.68 110.821 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.11 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 2.82 111.453 176.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . 0.469 ' CG ' HD23 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 3.96 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 2.22 113.23 -178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 3.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 3.61 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.62 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 2.51 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 2.64 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 5.38 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 5.27 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.44 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 3.58 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 4.03 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.96 112.241 -174.196 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 113.856 1.058 . . . . 3.84 113.856 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 5.6 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 5.32 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 4.05 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.84 110.383 169.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.38 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 4.67 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 3.48 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.88 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 3.58 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 3.81 114.153 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 3.21 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 4.03 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 2.28 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.53 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 3.07 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 3.52 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 2.66 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 2.24 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 2.08 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 1.96 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 1.87 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 3.39 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 3.58 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 3.43 111.512 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 3.5 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 4.25 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 2.14 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 3.3 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 4.06 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 2.17 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 2.5 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 7.99 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.83 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 3.69 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 3.45 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.43 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 6.04 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 5.7 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.97 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 4.83 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 4.07 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 1.83 110.442 -168.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 3.39 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 1.21 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 1.96 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 1.94 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.46 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 4.07 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 3.05 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.9 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.74 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 4.12 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 5.14 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 2.42 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 3.03 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 2.14 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.83 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.29 111.867 173.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 4.22 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 3.62 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 6.25 110.996 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 6.42 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 3.37 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 5.85 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 4.24 109.441 173.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 8.62 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 3.02 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 7.11 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 8.26 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 5.59 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 3.03 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 3.03 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 2.06 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.77 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 1.99 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 1.96 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 3.97 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 3.12 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.91 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.8 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.62 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 2.24 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 2.3 109.871 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.31 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 3.12 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 3.81 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.87 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 3.26 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 3.64 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.43 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 2.28 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 2.71 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.7 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 6.82 112.939 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 2.25 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 3.8 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.45 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.53 110.5 171.613 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.79 113.932 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 6.72 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 6.71 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 3.88 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 2.38 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 2.59 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.44 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 2.1 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 3.63 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 4.22 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 3.07 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 4.01 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 3.16 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.65 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.7 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 3.61 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 3.33 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 2.32 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 2.03 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 2.06 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 2.42 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 2.67 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 3.19 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 3.58 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 2.67 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 3.94 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 2.36 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 3.37 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 1.06 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 3.78 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 2.23 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 2.15 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 8.61 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.77 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.8 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.66 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 6.86 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . 0.428 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 4.8 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 3.15 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . 0.428 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 5.06 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 4.34 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 2.11 110.845 -159.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.96 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 3.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 1.07 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 2.33 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.87 111.187 173.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.52 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 4.27 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 4.98 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.6 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 5.71 115.874 -162.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 5.35 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.26 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 4.22 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 3.41 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 3.62 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 2.02 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 2.07 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.23 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.22 112.084 165.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 4.61 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 3.55 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . 0.479 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . 0.479 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 7.2 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.67 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 3.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 5.01 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 3.25 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 7.58 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.5 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 5.16 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 7.01 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.93 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 2.75 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 3.12 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 1.94 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.89 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 2.28 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 2.09 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 3.59 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 3.24 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 4.61 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 1.94 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 7.29 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 2.3 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 2.33 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.28 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 3.23 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 5.69 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.96 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 1.88 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 5.45 112.325 170.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 3.72 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.92 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 2.24 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 3.68 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 5.43 110.115 163.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 8.31 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 2.29 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 3.43 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.66 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 3.24 111.282 -178.665 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 CA--C 1.548 0.87 0 CA-C-O 119.316 -0.373 . . . . 7.41 111.871 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 5.16 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 7.77 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 3.82 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 2.67 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 3.24 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.69 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.4 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 4.06 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 4.16 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 5.4 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.77 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.53 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.27 113.495 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 2.39 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 4.0 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 3.77 112.166 -176.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 2.39 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 2.19 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.67 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 2.79 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 3.28 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 3.41 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.9 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 2.53 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 3.84 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 2.62 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 3.81 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.98 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.26 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.65 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 4.57 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 2.57 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 3.76 110.412 -164.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 13.2 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.54 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 5.16 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.53 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 7.11 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 4.07 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 3.06 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 5.53 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 3.69 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 2.14 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 4.41 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 2.84 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 2.61 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.58 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 4.72 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 3.26 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 3.8 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 5.58 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 4.07 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.91 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.74 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 3.5 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 3.19 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 2.74 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 2.08 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.49 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.63 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 6.71 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 4.24 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 7.58 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.82 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 3.51 109.031 174.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 4.44 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 4.71 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 7.54 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 4.53 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 4.42 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 10.69 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 4.56 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 3.03 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.89 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 2.96 113.616 -174.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 5.34 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 2.34 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.61 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 3.69 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 2.74 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 5.04 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 2.1 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 7.53 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 2.86 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 3.1 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.48 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 3.63 111.581 171.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 4.31 111.668 170.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 2.15 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 3.74 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 3.93 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.91 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 2.53 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 3.87 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 5.41 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 8.34 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.98 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 4.04 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 5.27 111.881 174.182 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 112.864 0.69 . . . . 4.5 112.864 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 6.7 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 5.87 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.94 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 2.29 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 2.59 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.92 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 2.01 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 4.26 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 3.62 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 2.91 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 4.21 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.97 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.45 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.99 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 3.55 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 2.59 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 2.12 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 1.76 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.73 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 2.42 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.75 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 5.65 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 3.64 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 3.15 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 3.48 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.464 HG12 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 2.6 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 3.3 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.14 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 4.11 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 2.18 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 3.9 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 8.82 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.96 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 3.27 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 3.57 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 2.01 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.94 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 6.19 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.87 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 5.46 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 3.98 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 2.11 110.673 -162.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 4.57 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 6.08 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 1.97 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 1.94 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.48 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 3.9 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 3.45 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 3.29 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.99 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.4 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 5.4 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.85 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 3.67 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 1.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.69 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.77 111.738 171.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 5.32 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 3.77 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 6.49 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.91 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 4.28 114.224 -164.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 5.75 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.97 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.51 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.72 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 4.29 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 6.14 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 4.27 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 3.19 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 3.19 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 2.29 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 4.24 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 1.93 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 1.73 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.464 ' CE1' HG12 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 4.62 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 3.53 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 6.93 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 2.1 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.83 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 3.22 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 2.46 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.61 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 3.45 111.607 172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 3.42 111.603 172.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.81 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 3.01 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 3.32 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.26 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 3.43 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 3.11 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.89 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 8.33 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 3.02 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 3.7 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.89 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 4.27 111.176 171.003 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.8 118.991 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.99 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.83 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 3.52 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.87 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 2.32 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 3.04 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.93 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 3.78 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 3.31 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 2.68 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 3.27 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.84 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.57 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 3.12 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 3.71 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 2.74 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 2.33 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 2.14 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 1.67 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 2.01 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 3.54 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 3.94 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.97 113.74 -151.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 3.1 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 3.78 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 2.09 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 3.29 111.583 165.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.7 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.49 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 4.19 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 2.87 114.658 -169.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 2.83 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 10.08 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . 0.477 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 4.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.99 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.87 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 5.22 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 5.71 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.68 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 3.84 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 4.04 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 1.73 110.92 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 3.93 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 2.12 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 2.07 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.47 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 4.28 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 2.59 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 3.33 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 5.13 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 6.21 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 3.68 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 3.18 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 2.05 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 2.49 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.46 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.2 111.204 164.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 4.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 3.8 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 7.8 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 7.5 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 3.38 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 5.69 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 3.4 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 8.42 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.53 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 4.41 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 9.54 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.95 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 3.0 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 2.75 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 2.42 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.73 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 2.11 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 2.13 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 3.69 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 3.23 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.9 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 1.91 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.83 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 3.63 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 2.35 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 3.04 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 3.59 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 3.66 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 2.06 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 2.67 114.722 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 3.88 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.69 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 3.02 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 2.7 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 5.01 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 6.28 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 2.15 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 3.64 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.92 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 4.27 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 3.02 111.754 -178.518 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.82 116.366 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 5.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 5.35 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 3.52 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 2.02 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.81 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 4.35 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.85 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 4.03 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.88 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 3.8 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 3.16 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.43 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 2.0 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.16 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 2.52 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 3.21 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 2.39 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 1.94 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 1.65 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 1.67 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 2.03 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 2.65 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 3.61 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 2.98 113.401 -166.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 3.15 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 3.36 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.97 111.985 175.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 3.52 111.777 168.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.33 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 4.96 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 2.0 112.869 -175.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 3.21 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 9.26 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 3.66 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 4.06 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 5.0 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 5.89 113.519 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.74 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 3.98 111.78 -174.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 3.98 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.88 111.77 -165.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 4.33 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 1.08 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 2.1 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 1.89 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.71 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 4.11 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 2.54 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 3.63 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 6.3 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 5.2 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.481 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 5.11 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 3.05 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 3.2 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 2.16 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 2.18 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.32 111.325 167.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 9.45 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 3.7 115.476 -173.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 7.26 114.386 168.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.8 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.69 114.578 -169.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 4.47 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 3.65 112.859 177.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 8.59 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 3.21 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.77 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 7.53 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 4.56 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 2.77 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 3.22 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 2.38 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.98 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.86 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.95 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 4.42 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 3.24 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.94 108.382 169.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 1.76 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 8.39 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 2.54 108.836 -171.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 3.84 111.984 -176.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 3.92 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 1.81 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 2.88 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 3.17 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.53 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.63 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 3.02 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 7.76 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 5.42 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 2.43 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 4.36 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.84 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 3.32 112.133 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.543 0.942 . . . . 4.89 113.543 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 6.98 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 5.4 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 3.73 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.8 111.405 176.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.88 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 3.11 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.19 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 4.49 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 3.52 112.061 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 2.6 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.84 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 2.21 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.96 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 4.55 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 3.46 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 4.06 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 2.36 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 2.16 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 1.82 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 1.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 3.46 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 3.83 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 3.25 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 2.45 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 3.52 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 2.2 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 3.73 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.57 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.13 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 3.95 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 2.26 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 3.42 111.8 -168.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 11.6 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.99 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 5.54 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 5.06 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 6.67 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 5.12 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 2.88 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 4.51 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 3.58 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 1.77 110.761 -165.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 5.16 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.92 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 1.96 109.033 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 1.84 110.818 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 3.59 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 3.22 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.49 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.96 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 7.43 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 3.81 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 2.88 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 2.12 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.85 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.28 114.129 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 7.2 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 3.69 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 8.45 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 7.23 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 3.02 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 6.31 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 5.33 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 7.68 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.55 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 8.0 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 6.69 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 5.83 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 2.81 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.35 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 2.1 115.625 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 5.91 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 1.85 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 1.78 110.186 -167.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 4.31 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.86 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.79 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 1.87 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.68 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 3.4 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 2.56 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 2.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.54 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 4.33 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.76 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 3.34 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 3.48 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.38 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 2.68 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 2.93 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.75 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 8.89 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.63 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 4.58 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.73 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.86 110.851 177.439 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 4.04 116.471 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 5.46 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 5.35 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 3.45 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 2.37 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.45 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.9 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 3.23 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 3.13 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 3.64 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 3.71 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.96 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 3.56 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 2.04 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.26 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 2.55 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 3.41 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 3.94 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.78 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 1.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 2.2 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 2.21 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 3.1 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 5.78 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 3.14 110.056 -173.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.84 111.937 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 4.79 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 2.28 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 3.3 111.666 168.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.83 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.38 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 4.01 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 2.01 115.409 -160.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 2.1 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 8.44 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.65 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 3.55 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 3.35 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.99 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 5.56 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.86 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 3.12 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 3.74 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 3.98 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 2.33 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.36 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 3.94 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.41 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 2.14 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 1.94 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.37 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 3.54 107.812 -141.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 2.86 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 3.08 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 6.03 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.79 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.521 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 5.71 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 3.17 110.33 162.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 3.39 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 2.15 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.75 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.85 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.77 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.43 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 3.62 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.68 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 7.21 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 2.87 114.574 167.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.79 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.57 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 7.51 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.72 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.71 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 6.65 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 4.06 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.49 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 3.36 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.96 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 5.32 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 2.15 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.93 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 5.34 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 3.65 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 4.42 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 2.48 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.93 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.99 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 4.21 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.87 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 3.99 109.584 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 3.9 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 3.76 109.447 168.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 1.94 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 3.12 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 3.51 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.39 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 3.33 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 2.82 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.69 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 8.17 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 2.27 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 3.42 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.91 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 4.32 111.945 -175.172 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 5.85 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 4.35 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 3.08 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 2.0 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.81 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.88 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.92 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 3.88 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 3.53 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 2.26 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 2.16 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.78 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 3.2 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 2.56 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 2.16 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 1.77 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 2.49 114.512 171.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 1.91 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 3.08 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 3.24 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 3.45 112.311 -157.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 4.44 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 4.34 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 2.38 111.776 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 3.14 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.55 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 5.31 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 2.21 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 2.23 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 8.18 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.76 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 3.74 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.89 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.55 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 5.87 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 8.02 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 3.21 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 6.02 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 3.83 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 2.07 111.458 -170.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 3.8 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.31 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 2.05 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 1.98 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.35 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.92 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 3.44 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.87 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 5.67 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 5.48 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 4.0 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.87 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 3.45 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 2.32 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 3.59 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 5.14 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 3.67 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 9.23 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 7.06 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 3.18 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 5.46 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 5.32 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.76 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.79 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 5.32 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 8.24 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 4.9 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 2.43 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 3.67 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.98 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 6.05 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.8 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 2.02 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 3.88 108.577 170.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 3.63 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.87 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 2.37 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.74 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 2.49 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 2.25 111.062 -177.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.65 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 3.04 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.41 112.775 174.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 3.85 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 2.19 112.633 -172.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 3.12 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 3.35 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.62 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.88 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 3.38 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 7.33 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 7.66 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 2.59 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 3.76 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.79 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 4.02 111.02 175.027 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.084 0.772 . . . . 3.86 113.084 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 5.13 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 4.66 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 4.24 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 2.01 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 2.19 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.95 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.67 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.47 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 3.54 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 3.45 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 2.93 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 2.04 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.13 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 2.25 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 3.15 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 2.38 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 1.96 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.92 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 2.53 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 2.18 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.86 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 6.1 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 3.62 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 2.87 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 3.75 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 1.87 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 3.25 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.43 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 3.9 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 2.11 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.81 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 9.6 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.84 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 3.04 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.86 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 4.61 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 4.29 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 2.81 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 3.8 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 4.93 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.7 110.287 -161.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 3.83 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 1.21 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 1.95 108.117 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 2.0 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.25 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 3.71 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 2.34 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.78 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 7.26 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 4.28 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.73 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 7.24 116.306 -168.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 2.2 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 3.32 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 2.69 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.99 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.45 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.26 111.852 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 5.4 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 4.07 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 3.05 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . 0.445 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . 0.445 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.87 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 8.35 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 4.54 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 4.47 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.9 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 11.32 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.99 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 4.53 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 8.71 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 4.26 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 3.15 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 2.58 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 2.06 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 5.21 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 2.12 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 2.22 109.306 -175.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 4.86 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 3.13 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 4.08 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 1.82 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.3 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 2.25 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 2.24 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.63 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 3.63 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 3.68 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.3 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 2.13 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 2.66 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 3.69 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 2.07 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 3.46 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 3.32 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 5.5 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 6.0 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.78 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 3.6 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 5.56 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.95 111.745 174.076 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 113.866 1.061 . . . . 4.06 113.866 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 5.21 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.64 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 3.5 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.94 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 2.21 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 3.13 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.83 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 4.62 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 3.55 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 2.6 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 3.74 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 2.33 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.28 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.62 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 3.43 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 2.26 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.92 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 1.81 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 1.94 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 2.23 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.99 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' LYS . . . . . 0.433 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 3.22 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 561' ' ' LYS . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 3.43 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' LYS . . . . . 0.462 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.94 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 3.73 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' VAL . . . . . 0.481 HG12 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 1.98 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 4.11 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 3.93 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.98 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 2.3 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 8.5 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 3.84 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 3.29 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 2.1 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 5.22 113.056 -167.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.87 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 3.39 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 4.34 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 3.66 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.93 109.627 -172.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 4.26 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.38 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 2.31 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.86 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.71 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.94 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 3.55 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.41 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 6.66 115.87 -161.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.85 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.83 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.57 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 3.41 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 2.76 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 2.51 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.84 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.64 110.583 160.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 5.19 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 4.1 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 8.41 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 4.14 112.898 -164.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 7.8 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 5.27 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 9.01 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.78 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 7.46 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 3.56 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 2.32 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 2.55 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 1.97 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 4.1 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.98 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.92 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 627' ' ' TYR . . . . . 0.481 ' CE1' HG12 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 4.66 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 3.48 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 5.58 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 2.45 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.53 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 3.0 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 3.85 112.02 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.72 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 2.66 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 4.4 111.438 175.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 2.02 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 3.71 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 3.55 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.84 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 2.58 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 3.11 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 5.02 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 6.42 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.65 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 4.0 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.55 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 4.08 111.706 173.394 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.344 1.238 . . . . 9.84 114.344 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m -73.42 38.6 0.09 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.647 2.379 . . . . 4.46 116.017 -170.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 7.11 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.93 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 4.83 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 2.32 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 3.07 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.59 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 4.01 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.9 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 3.64 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 4.08 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 4.57 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 2.34 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.49 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 4.1 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 2.39 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 2.43 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 2.19 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 2.13 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 2.47 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 2.58 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 3.16 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 3.7 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 2.43 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 4.3 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 2.31 111.793 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 3.71 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.61 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 4.42 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 2.19 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 3.15 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 10.76 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 4.08 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 4.64 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 2.08 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 5.2 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 5.55 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.66 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 3.62 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 4.1 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 2.17 111.885 -159.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 3.61 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.89 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 2.22 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 2.23 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.49 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 3.36 107.743 -140.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 3.4 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.85 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.98 114.664 -169.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.93 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 6.33 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 3.61 110.739 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 3.93 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 2.71 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 2.16 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.61 113.502 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 7.18 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 3.57 113.835 175.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 8.9 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 6.75 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.76 113.349 174.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 5.98 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 5.58 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 7.81 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.88 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 4.51 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 6.83 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 4.48 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 3.03 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.73 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 2.49 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 6.2 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 2.01 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.95 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 5.21 106.921 164.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 2.84 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 4.27 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 2.08 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.9 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 3.16 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 3.47 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.2 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 3.74 110.89 -174.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 4.15 109.322 161.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 2.01 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 3.65 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 3.76 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.62 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 3.83 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 3.25 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 4.73 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 6.32 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 3.44 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 5.0 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 5.5 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -62.13 -26.05 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.68 112.493 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -52.68 -12.36 0.29 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 125.652 1.581 . . . . 4.04 114.817 166.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 13.5 tt -139.08 -27.67 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.639 1.348 . . . . 8.55 114.639 161.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.12 -18.5 65.33 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.404 -1.435 . . . . 5.15 114.772 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -71.61 -11.81 61.04 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 116.961 2.208 . . . . 8.03 116.961 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.28 -50.57 64.59 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.206 1.187 . . . . 9.62 114.206 -162.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -99.69 10.9 40.53 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.455 1.28 . . . . 10.7 114.455 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -84.15 5.32 26.7 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.573 -1.33 . . . . 14.35 113.593 -174.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 1.7 mp -33.9 88.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 130.309 3.444 . . . . 16.94 117.205 -160.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 64.59 19.13 64.52 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 126.55 2.024 . . . . 21.2 114.881 165.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -73.81 150.22 41.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.547 1.174 . . . . 22.1 112.357 -172.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -103.15 151.68 22.31 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.882 1.273 . . . . 28.21 110.647 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.0 -51.08 69.49 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.532 0.733 . . . . 29.71 111.769 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 44.1 p -125.46 -72.08 0.68 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.901 1.68 . . . . 32.65 110.912 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 24.1 pt -151.67 159.59 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 127.578 2.351 . . . . 38.03 110.625 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 35.3 tp -91.86 57.7 3.24 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.641 1.577 . . . . 36.79 110.382 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 47.8 tp -132.86 133.89 43.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.217 1.407 . . . . 42.43 111.401 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 . . . . . 0 C--O 1.256 1.41 0 C-N-CA 129.642 3.177 . . . . 46.0 116.166 -177.673 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 CA--C 1.554 1.115 0 N-CA-C 109.237 -0.653 . . . . 9.08 109.237 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.62 42.66 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.804 1.642 . . . . 4.53 114.661 -169.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 4.73 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.97 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 3.49 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.82 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 2.08 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 3.23 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 2.13 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 3.28 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 3.43 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 2.3 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.84 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 1.92 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.13 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 2.47 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 3.09 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 2.22 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 1.77 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 1.71 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 1.68 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 1.95 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 2.37 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 3.44 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 3.27 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 2.53 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 3.75 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.41 HG12 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 1.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . 0.421 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 3.06 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.96 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 3.52 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.421 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 1.89 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 2.26 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 8.25 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.92 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 4.3 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.56 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 5.05 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 4.11 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 2.48 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 3.62 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 4.08 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 1.73 110.336 -166.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 3.76 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.9 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 1.68 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 1.61 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.17 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 3.53 107.628 -142.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 2.41 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.64 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.5 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.75 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.488 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.488 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 5.72 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 2.39 111.825 -169.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 2.87 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 1.96 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 2.13 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.21 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.97 111.862 172.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 4.59 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 3.72 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.68 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 8.23 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . 0.423 HD21 ' CD2' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 4.12 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 5.23 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 4.03 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 7.14 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.85 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.73 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 11.71 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.1 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.89 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 4.22 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 2.03 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.81 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 1.86 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 2.09 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.41 ' CE1' HG12 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 4.45 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 3.32 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 5.24 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 1.9 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 8.23 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.37 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 2.57 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.25 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 2.9 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . 0.423 ' CD2' HD21 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 3.7 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 1.74 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 3.84 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 3.46 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.72 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 2.68 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 2.44 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 6.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 7.65 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.3 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 3.87 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p -102.55 -37.43 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.26 111.755 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -51.86 -41.78 62.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.207 1.003 . . . . 5.41 113.17 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -64.98 -10.94 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 114.931 1.456 . . . . 8.56 114.931 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -117.9 -36.45 3.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.587 1.555 . . . . 7.49 112.092 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -66.07 -18.2 65.19 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.36 1.464 . . . . 8.77 113.592 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 35.8 tp -47.38 -33.7 6.22 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.54 2.336 . . . . 7.99 115.386 171.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -50.01 142.65 9.01 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.368 1.618 . . . . 11.33 115.368 -171.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -62.58 -3.15 1.32 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.985 2.514 . . . . 15.65 117.197 -163.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 10.8 mm -71.8 99.76 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 123.605 1.669 . . . . 17.77 113.447 -157.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 59.83 23.23 58.69 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.117 2.294 . . . . 21.65 113.037 -169.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -140.54 147.15 39.06 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.301 1.44 . . . . 20.86 113.853 -161.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -67.66 155.75 38.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.848 1.259 . . . . 25.78 110.517 172.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -129.19 173.12 10.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.76 1.624 . . . . 21.78 112.704 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.8 m -146.88 -173.54 4.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.718 1.607 . . . . 23.27 112.533 -175.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 20.2 pt -66.15 150.93 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.701 2.001 . . . . 25.49 112.848 172.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -105.92 166.06 10.75 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.636 1.347 . . . . 22.79 114.636 -172.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 51.2 tp -84.02 145.92 28.24 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.545 1.313 . . . . 25.86 114.545 -175.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 52.6 t60 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 131.022 3.729 . . . . 30.55 115.733 169.178 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 110.468 -0.197 . . . . 8.59 110.468 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m -65.59 145.61 55.86 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 170.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 8.88 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 8.01 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 3.18 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 2.12 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.83 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.67 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.8 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.74 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 3.4 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 3.65 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 2.58 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 3.13 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.86 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.55 113.962 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 2.6 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 3.97 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 3.81 112.498 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 2.02 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 1.73 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.91 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 1.97 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 2.93 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 3.34 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.495 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 3.31 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . 0.495 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.65 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 3.57 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 1.82 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 3.86 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.33 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 4.68 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 2.64 112.737 -173.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 3.92 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 10.2 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 5.03 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.29 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 3.14 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 3.57 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 2.18 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 5.6 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 7.31 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.93 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 3.84 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 4.54 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 2.02 109.639 -155.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 3.52 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 2.53 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 2.23 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 3.63 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 3.02 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 3.49 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.82 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 5.15 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 5.55 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 3.24 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 3.06 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 2.29 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.69 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.78 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.41 111.963 170.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 5.29 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 4.48 110.36 176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.99 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 6.21 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 6.11 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 4.15 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 4.68 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.76 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.85 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.71 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 6.2 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 8.31 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.95 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 3.64 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 2.75 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 1.8 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 6.09 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 1.77 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.84 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 4.18 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 3.05 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 3.59 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 2.4 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.2 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 3.54 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 2.59 106.236 174.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 3.43 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 3.87 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 2.15 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 3.19 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 4.04 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.67 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 2.47 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 3.2 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 7.72 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 6.62 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 2.19 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 3.29 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.68 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p -79.16 -32.79 15.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.96 111.201 -174.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.55 -22.32 32.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.634 1.174 . . . . 2.95 113.941 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.3 tt -98.05 -46.15 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.334 1.054 . . . . 5.06 112.107 167.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.16 -39.78 93.8 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.418 1.008 . . . . 4.41 113.309 -174.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -65.75 -28.15 68.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.468 1.907 . . . . 6.18 114.03 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.93 -25.09 13.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.239 1.416 . . . . 5.34 111.687 -172.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.68 162.28 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.454 2.702 . . . . 7.31 114.201 -173.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -75.52 -58.18 3.44 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.982 -1.074 . . . . 15.36 111.645 -170.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 17.2 mm 60.56 137.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 126.853 2.061 . . . . 13.13 114.6 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -66.35 -35.98 91.0 Favored Glycine 0 CA--C 1.532 1.133 0 O-C-N 120.366 -1.459 . . . . 17.29 113.355 -173.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -79.94 9.04 5.82 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.894 1.813 . . . . 17.2 115.894 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -59.97 148.04 36.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.973 1.309 . . . . 21.08 112.544 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -72.05 154.2 41.27 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.953 0.901 . . . . 24.03 111.615 169.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 23.8 m -70.9 178.44 3.15 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.848 -1.158 . . . . 26.05 112.71 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 21.4 pt -56.59 162.81 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.892 1.441 . . . . 29.48 114.892 -169.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 46.4 tp -107.18 142.94 36.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.635 1.974 . . . . 28.0 112.089 -174.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.481 HD11 ' H ' ' A' ' 672' ' ' HIS . 51.3 tp -72.86 155.28 40.07 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.785 1.032 . . . . 33.68 113.785 -175.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.481 ' H ' HD11 ' A' ' 671' ' ' LEU . 68.4 t60 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 128.981 2.913 . . . . 35.95 116.352 -170.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 29.4 m120 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 115.027 1.491 . . . . 7.19 115.027 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t -51.4 -30.4 18.99 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.427 1.891 . . . . 3.78 114.914 -172.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 4.45 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 5.42 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 4.58 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 2.33 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.8 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 5.14 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 3.06 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.46 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 3.79 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 4.16 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 3.42 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 3.3 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 2.42 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.92 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.92 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 3.3 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 3.02 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 2.11 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 1.76 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.78 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 2.36 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.46 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.95 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 561' ' ' LYS . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 3.28 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . 0.433 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 2.55 112.611 -173.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 4.37 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.42 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 2.08 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 3.34 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.77 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.27 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 3.66 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.92 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 2.65 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 9.2 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.2 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.96 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 4.07 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.55 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.77 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 4.02 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 3.03 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 4.08 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 4.42 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 1.98 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 3.61 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 1.01 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 1.74 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 1.78 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 3.74 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 3.21 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.51 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.81 110.287 172.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 7.03 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 5.8 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 3.65 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 2.56 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 2.31 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 2.25 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.38 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 4.64 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 3.64 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.9 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 7.31 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 4.2 115.96 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.91 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 3.59 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 9.38 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 4.52 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 4.68 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 7.16 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 5.03 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 3.26 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.36 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 2.04 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 4.27 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 1.59 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 1.77 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.42 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 4.48 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 3.15 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 3.39 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 1.84 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 7.41 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.65 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 2.28 110.438 -170.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 3.07 111.28 -172.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 3.67 111.468 175.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 2.16 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 3.1 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 3.6 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 2.38 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 3.58 110.787 -177.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 5.45 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 7.02 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 3.07 112.961 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 3.84 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.08 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -104.8 -29.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.64 112.622 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.53 -36.35 64.16 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.67 1.188 . . . . 3.57 112.276 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.8 pp -66.3 -8.47 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 114.694 1.368 . . . . 7.17 114.694 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -103.7 -38.58 7.02 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.88 1.272 . . . . 7.22 112.459 164.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -80.44 -13.4 59.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.476 1.511 . . . . 9.59 114.572 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.9 tt -101.47 -21.73 14.7 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.494 1.518 . . . . 7.91 113.884 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -139.06 175.86 9.19 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 125.648 1.579 . . . . 9.15 110.543 -175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -92.12 -9.39 42.71 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 118.22 2.674 . . . . 13.24 118.22 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . 0.503 ' H ' HD13 ' A' ' 663' ' ' ILE . 0.8 OUTLIER -68.4 -36.63 75.69 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 116.874 2.175 . . . . 9.93 116.874 -157.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 91.44 18.45 45.41 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.059 1.314 . . . . 14.03 116.048 -175.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -117.27 137.47 52.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.963 2.105 . . . . 15.14 110.481 -176.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -135.45 155.85 49.87 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.45 1.1 . . . . 23.04 113.465 -171.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -107.97 174.48 5.86 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.633 1.973 . . . . 22.14 112.765 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.6 p -134.26 -145.72 0.24 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.798 1.239 . . . . 25.96 112.165 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.3 pt -84.09 166.84 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.093 1.357 . . . . 31.8 112.893 -175.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 97.0 mt -95.13 149.06 21.7 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.089 0.956 . . . . 31.6 109.234 156.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.9 tp -144.06 168.45 19.98 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.763 1.268 . . . . 35.74 114.192 -167.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.264 0 C-N-CA 129.766 3.226 . . . . 42.33 112.414 169.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 59.9 t30 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 120.784 0.326 . . . . 7.63 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m 70.01 12.88 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 4.24 116.899 171.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 6.44 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 6.98 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 3.19 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.98 111.097 172.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 2.14 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 3.37 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.67 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.97 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 4.35 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 3.68 112.337 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 2.48 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 3.42 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 2.14 114.466 -168.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.58 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 3.51 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 3.7 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 2.59 112.134 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 2.97 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 2.17 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 1.84 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 2.39 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 3.91 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 3.51 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 3.57 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 3.64 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 3.23 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . 0.408 ' CD ' ' HG ' ' A' ' 632' ' ' SER . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 1.9 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 3.39 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.92 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 3.72 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.83 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 2.46 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 8.3 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 3.48 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.84 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.84 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 8.44 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 4.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.53 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 4.44 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 4.06 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 1.91 111.463 -169.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 3.04 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.98 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 1.95 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 1.84 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.42 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 3.59 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 3.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.75 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 5.13 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 4.22 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 4.28 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.32 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 3.05 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 3.25 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 1.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 2.0 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.23 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.97 112.392 174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 4.97 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 3.7 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 6.54 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 6.46 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 3.21 115.331 -173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 5.18 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 4.01 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 8.6 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 2.19 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 4.26 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 7.25 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 4.19 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 2.56 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.86 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 1.97 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 5.43 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 1.64 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 1.85 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 4.47 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.99 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 4.83 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 2.14 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.66 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 632' ' ' SER . . . . . 0.408 ' HG ' ' CD ' ' A' ' 563' ' ' GLU . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 2.61 113.364 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 2.36 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 3.88 110.902 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 4.32 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.89 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.96 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 3.72 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.85 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 2.57 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 3.1 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 5.52 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 6.54 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 2.26 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 3.82 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.45 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 3.06 113.068 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.32 -23.89 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.479 1.289 . . . . 2.9 114.479 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -70.64 -24.38 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.603 1.161 . . . . 5.06 113.287 172.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -95.09 -48.45 5.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.958 1.303 . . . . 5.86 111.647 177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 92.1 mtt-85 -64.82 -10.64 29.62 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.28 1.832 . . . . 7.55 114.213 174.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 67.6 tp -38.75 -46.35 1.24 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.57 1.948 . . . . 5.62 112.404 161.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -93.45 132.15 37.98 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.452 1.101 . . . . 7.85 112.355 177.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 3.2 ppt_? -79.82 4.49 16.36 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.223 2.209 . . . . 15.34 116.375 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.3 1.2 mp 49.26 153.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 130.662 3.585 . . . . 13.46 116.785 -170.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -69.04 152.98 52.68 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 120.818 -1.177 . . . . 16.42 110.515 162.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.43 168.74 9.39 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.074 0.949 . . . . 19.93 113.164 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -73.75 44.91 0.18 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.799 2.04 . . . . 29.2 112.358 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -63.2 145.75 54.84 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.244 1.418 . . . . 27.14 113.236 -163.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 72.1 p -158.81 -176.9 6.14 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.292 1.437 . . . . 31.7 112.651 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.7 pt -101.92 154.4 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.0 1.32 . . . . 38.02 113.494 -162.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 72.7 mt -127.3 168.48 14.72 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.906 1.682 . . . . 38.21 112.467 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.401 HD11 ' H ' ' A' ' 672' ' ' HIS . 60.3 tp -66.94 153.97 42.24 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.685 1.994 . . . . 45.54 113.617 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.401 ' H ' HD11 ' A' ' 671' ' ' LEU . 20.4 t-80 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 129.534 3.134 . . . . 48.23 114.162 178.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 50.9 t30 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.879 0.371 . . . . 7.94 111.635 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m -99.06 141.23 32.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.125 0.97 . . . . 7.99 112.396 -172.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 7.07 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.93 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 4.17 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 2.09 111.43 177.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 2.13 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.88 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 2.12 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 3.33 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 3.51 113.448 175.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 2.32 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 3.25 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 2.09 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.2 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.74 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 3.41 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 2.43 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 1.67 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 1.78 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.86 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 1.95 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 2.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 3.79 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 3.66 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 4.69 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 3.96 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.49 HG12 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 2.19 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 3.75 111.316 167.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 3.53 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 2.59 113.119 -169.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 3.28 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 8.09 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 4.03 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 3.6 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 3.2 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.96 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 5.36 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.89 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 2.86 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 4.21 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 3.67 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 1.81 110.699 -164.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.7 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.11 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 2.31 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 1.74 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 3.65 108.582 -138.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 3.65 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.73 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 6.77 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.75 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.471 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.471 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 4.56 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 2.57 112.14 -169.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 3.21 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 1.96 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 4.53 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 1.07 112.688 175.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 4.55 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 3.58 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 9.11 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 6.11 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.7 114.005 -163.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 6.53 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 4.51 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.82 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.5 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 4.3 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 7.16 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 5.46 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 2.78 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.57 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 2.16 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 5.13 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.87 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 2.03 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG12 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 5.39 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 3.52 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 5.46 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.59 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.56 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 3.13 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 2.34 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 3.86 111.007 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.61 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 3.89 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 2.04 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 3.04 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 3.67 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.37 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 2.69 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 2.47 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 5.56 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 6.64 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 2.2 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 3.81 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 4.03 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p -70.0 -36.74 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 3.34 111.202 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.41 -18.34 38.29 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.354 1.242 . . . . 3.52 114.354 177.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -108.76 -28.39 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.678 1.191 . . . . 6.05 113.701 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.47 -25.81 61.57 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 119.869 -1.77 . . . . 4.23 113.055 171.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -91.71 -16.35 27.07 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.589 1.955 . . . . 6.76 113.029 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 9.0 tt -74.06 -23.82 59.43 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.576 1.55 . . . . 5.97 112.651 165.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.73 156.59 34.97 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.245 1.202 . . . . 7.13 114.245 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.04 -14.32 62.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.299 2.239 . . . . 12.49 114.654 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 16.8 mm 54.69 -105.5 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.161 1.785 . . . . 11.16 111.837 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -91.97 -4.51 67.0 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.998 1.761 . . . . 14.51 114.717 -179.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -80.75 111.09 16.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 118.042 0.921 . . . . 14.44 109.457 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -127.67 -18.67 4.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.735 2.014 . . . . 21.91 112.731 -172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -71.8 -35.16 69.89 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.13 0.789 . . . . 24.25 113.13 -170.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 19.4 m -77.77 179.34 6.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.899 1.279 . . . . 22.18 112.79 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 23.4 pt -69.03 158.8 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 125.945 1.698 . . . . 26.92 113.732 -172.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.13 177.41 8.83 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.639 1.576 . . . . 26.01 113.791 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 128.04 34.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.631 1.172 . . . . 27.24 110.495 175.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.327 0 C-N-CA 127.911 2.484 . . . . 33.86 113.625 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 107.797 -1.186 . . . . 7.87 107.797 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t -58.72 -16.06 14.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 5.22 114.64 -175.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.97 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.83 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 3.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 2.18 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 2.1 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 3.25 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 3.38 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.41 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.84 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 3.54 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 2.6 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 3.19 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 2.09 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.31 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 4.25 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 3.6 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 2.56 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 2.21 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 1.97 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 2.04 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 2.07 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 4.35 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.79 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 3.47 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 3.67 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 4.02 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 2.14 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 3.58 111.139 169.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 4.34 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.42 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 3.96 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 2.03 114.683 -163.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 2.66 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 8.48 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.94 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 5.44 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 3.7 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.51 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 5.44 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 4.18 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 2.68 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 4.59 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 3.77 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.93 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 5.79 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.16 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 1.98 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 2.09 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.61 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 3.96 108.616 -137.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 3.25 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.82 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 4.57 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.59 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.53 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.53 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 5.25 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.94 113.075 -167.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.92 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 3.25 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.94 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.13 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 4.42 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 3.31 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.38 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 6.71 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.43 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 3.58 113.103 -162.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 4.73 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 4.69 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 13.43 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 5.29 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 4.31 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.96 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 6.1 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 3.15 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.78 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 2.15 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 5.45 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 2.19 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 2.14 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 5.51 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 3.7 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 5.21 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 2.01 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 7.32 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 2.17 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 2.61 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 2.75 112.092 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 3.82 111.98 163.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 2.12 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 3.84 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 3.42 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.73 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 3.24 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 2.94 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 6.93 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 6.77 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.19 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -101.48 -32.95 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.34 111.644 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -45.24 -41.56 8.58 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.993 1.717 . . . . 5.94 114.299 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -12.34 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 114.266 1.21 . . . . 9.71 114.266 -175.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -114.13 -29.36 7.0 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.957 1.703 . . . . 7.03 112.931 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -60.93 -24.15 65.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.802 2.041 . . . . 6.27 115.932 -166.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 5.8 tt -51.95 -57.23 10.05 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 9.45 113.607 -170.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -88.63 2.08 53.84 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.791 1.237 . . . . 10.95 113.712 -173.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -80.41 -25.71 38.87 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.659 1.355 . . . . 19.18 114.659 -169.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 12.5 mm 48.87 138.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 129.972 3.309 . . . . 16.87 118.199 149.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -73.13 21.59 1.03 Allowed Glycine 0 CA--C 1.538 1.521 0 O-C-N 119.914 -1.742 . . . . 21.0 115.921 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.32 133.4 44.97 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.663 1.585 . . . . 22.48 112.522 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -136.06 164.86 27.03 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.962 1.705 . . . . 31.0 111.265 -177.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -64.62 -18.73 65.19 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.656 0.782 . . . . 34.2 112.088 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 51.9 p -87.94 -42.68 12.31 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.274 2.23 . . . . 32.77 115.295 170.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 46.1 pt -144.8 153.86 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 114.962 1.467 . . . . 32.48 114.962 -161.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.76 165.92 25.24 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.723 2.809 . . . . 30.43 109.283 171.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.9 tp -147.23 81.08 1.53 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.633 1.346 . . . . 31.57 114.633 175.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 . . . . . 0 C--O 1.257 1.489 0 C-N-CA 127.699 2.4 . . . . 34.61 115.578 153.811 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 115.298 1.592 . . . . 9.25 115.298 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p -48.64 -34.09 11.14 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.76 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 7.78 113.887 167.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 3.59 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 2.27 110.703 173.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 2.77 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.81 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 2.18 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 3.73 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 4.0 112.999 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 2.24 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 3.31 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 2.11 114.057 -170.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.38 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 2.55 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 3.14 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 2.59 111.691 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 3.02 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 2.19 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.84 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 2.71 114.06 -165.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 3.37 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 4.28 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 3.78 112.064 -167.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.9 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 4.12 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 1.98 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 3.55 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 3.83 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 2.18 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 2.26 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 8.82 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 3.21 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 4.3 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 2.09 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 4.6 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 5.53 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 3.77 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 4.37 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 3.8 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 1.82 111.284 -161.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.92 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 5.36 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 1.17 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 2.09 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 1.96 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.59 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 4.3 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 2.85 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 4.25 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 7.03 117.7 -162.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 5.25 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.49 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 4.24 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 3.1 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 3.71 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 1.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 2.19 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.29 111.429 170.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 6.81 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 3.79 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 6.44 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 6.61 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.99 112.946 -167.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . 0.426 ' H ' HD11 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 4.17 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 3.37 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 8.02 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.7 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 6.27 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 6.49 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.91 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 2.33 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 2.5 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 2.26 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 4.36 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 2.13 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 2.25 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 4.66 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 3.59 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 3.5 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.92 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 8.12 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.61 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 2.25 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 3.74 112.19 -174.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 3.52 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.95 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.94 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 3.61 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.62 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 2.61 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 2.65 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 5.27 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 6.07 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 2.46 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 3.3 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.71 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p -99.22 -37.13 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 3.28 112.137 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -53.98 -36.55 63.03 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.447 0.906 . . . . 2.86 113.447 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -59.81 -21.16 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 114.258 1.207 . . . . 5.83 114.258 177.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -101.98 -32.59 10.1 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.603 1.561 . . . . 5.7 112.332 171.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.0 tpt85 -61.74 -34.02 75.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.86 1.264 . . . . 6.64 113.747 -176.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.68 -13.42 59.91 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.61 1.564 . . . . 6.92 112.425 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 t70 46.11 -129.23 1.32 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.932 2.093 . . . . 7.85 113.725 172.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -91.31 -1.81 57.55 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.225 1.565 . . . . 12.16 115.225 169.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 2.9 pp -106.84 10.56 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.672 1.989 . . . . 14.63 115.679 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -60.39 -32.4 77.22 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 118.459 -1.19 . . . . 18.28 114.972 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 47.65 78.84 0.07 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 127.42 2.288 . . . . 20.26 114.241 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -53.87 137.95 37.43 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.637 1.575 . . . . 27.02 113.236 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -105.21 133.5 49.88 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.411 1.484 . . . . 28.34 111.167 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.1 m -134.79 -173.92 3.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.776 1.23 . . . . 29.79 112.202 -175.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.8 pt -60.69 159.59 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.837 1.655 . . . . 35.24 115.094 -172.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.37 43.77 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.725 2.01 . . . . 36.13 110.882 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.473 HD12 ' H ' ' A' ' 672' ' ' HIS . 28.7 tp -149.59 157.96 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 122.684 1.231 . . . . 40.53 112.916 -170.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.473 ' H ' HD12 ' A' ' 671' ' ' LEU . 56.1 t-80 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.62 2.768 . . . . 43.68 114.293 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.463 -0.569 . . . . 8.79 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -104.24 -30.71 9.99 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.596 1.158 . . . . 3.56 112.583 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 6.59 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 4.37 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 3.42 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 2.63 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.84 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.78 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.76 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.77 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 3.82 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 3.77 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 2.81 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . 0.422 ' ND2' ' H ' ' A' ' 547' ' ' ASN . 5.1 p30 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 5.42 113.705 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 2.5 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.37 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 3.46 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 3.61 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 3.22 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 2.25 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 1.72 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 3.24 115.459 174.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 2.67 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 2.75 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 3.48 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 3.46 114.135 -159.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 2.71 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 4.29 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 3.1 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.502 HG12 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 1.89 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 3.55 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.24 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 4.02 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 2.55 115.626 -167.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.62 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 11.81 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.67 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.98 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 4.98 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 3.35 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 2.24 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.87 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 4.05 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 2.98 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 3.61 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 3.72 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 1.92 111.575 -164.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.87 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 3.46 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 2.14 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 2.03 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.81 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 4.17 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 2.47 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 3.17 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 5.18 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 4.72 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.94 112.125 177.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 3.27 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.81 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 2.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.9 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.17 111.551 167.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 4.17 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 3.76 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 8.3 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 7.35 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . 0.469 HD23 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 3.49 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 4.44 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.99 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 11.72 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 3.08 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 5.23 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 5.92 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 4.2 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 2.61 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.95 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.97 114.437 -172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 5.42 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 1.8 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.85 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.502 ' CE1' HG12 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 5.33 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 3.31 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 5.73 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 1.79 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.68 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 2.39 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 2.68 110.821 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.11 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 2.82 111.453 176.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . 0.469 ' CG ' HD23 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 3.96 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 2.22 113.23 -178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 3.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 3.61 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.62 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 2.51 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 2.64 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 5.38 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 5.27 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.44 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 3.58 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 4.03 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.38 -27.86 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.96 112.241 -174.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.04 59.42 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.186 1.551 . . . . 4.05 115.186 -178.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.8 tt -98.0 -10.09 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 126.026 1.731 . . . . 6.37 113.487 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -107.23 -38.29 6.02 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.057 1.343 . . . . 4.82 112.558 -174.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -72.57 -1.19 15.09 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.059 2.544 . . . . 6.82 115.764 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -75.02 -47.35 29.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.716 1.606 . . . . 7.05 112.092 -167.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 662' ' ' ARG . 8.2 t70 63.47 177.35 0.16 Allowed 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.54 2.336 . . . . 6.96 116.435 169.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.438 ' H ' ' CG ' ' A' ' 661' ' ' ASP . 2.9 mpt_? -90.26 -44.54 9.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.705 1.602 . . . . 12.01 112.508 -159.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 41.9 mm 66.03 -48.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 128.033 2.533 . . . . 11.33 117.793 164.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 146.17 60.18 0.02 OUTLIER Glycine 0 N--CA 1.469 0.88 0 C-N-CA 124.687 1.137 . . . . 15.36 110.542 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -144.77 138.02 26.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.413 1.485 . . . . 15.81 110.765 -153.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.4 -23.91 46.52 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.483 1.29 . . . . 25.28 114.483 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -68.44 136.01 52.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.342 1.057 . . . . 20.22 111.286 163.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.7 p -86.3 -52.74 5.44 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.656 1.583 . . . . 22.52 112.867 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.7 pt -146.78 160.29 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.03 1.332 . . . . 26.15 112.885 -166.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -131.9 12.57 4.79 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.358 1.463 . . . . 24.34 113.523 168.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.452 HD13 ' H ' ' A' ' 672' ' ' HIS . 25.0 tp -133.92 169.17 17.49 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.815 1.646 . . . . 27.77 111.106 -177.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.452 ' H ' HD13 ' A' ' 671' ' ' LEU . 36.9 t-80 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 128.342 2.657 . . . . 33.89 115.311 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 CA--C 1.555 1.169 0 N-CA-C 108.988 -0.745 . . . . 6.76 108.988 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t -52.32 -23.77 6.41 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.588 1.555 . . . . 3.84 113.856 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 5.6 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 5.32 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 4.05 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.84 110.383 169.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.38 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 4.67 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 3.48 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.88 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 3.58 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 3.81 114.153 179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 3.21 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 4.03 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 2.28 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.53 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 3.07 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 3.52 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 2.66 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 2.24 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 2.08 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 1.96 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 1.87 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 3.39 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 3.58 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 3.43 111.512 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 3.5 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 4.25 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 2.14 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 3.3 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 4.06 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 2.17 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 2.5 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 7.99 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.83 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 3.69 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 3.45 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.43 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 6.04 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 5.7 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.97 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 4.83 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 4.07 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 1.83 110.442 -168.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 3.39 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 1.21 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 1.96 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 1.94 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.46 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 4.07 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 3.05 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.9 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.74 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 4.12 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 5.14 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 2.42 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 3.03 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 2.14 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.83 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.29 111.867 173.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 4.22 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 3.62 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 6.25 110.996 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 6.42 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 3.37 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 5.85 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 4.24 109.441 173.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 8.62 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 3.02 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 7.11 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 8.26 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 5.59 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 3.03 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 3.03 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 2.06 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.77 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 1.99 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 1.96 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 3.97 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 3.12 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.91 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.8 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.62 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 2.24 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 2.3 109.871 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.31 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 3.12 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 3.81 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.87 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 3.26 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 3.64 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.43 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 2.28 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 2.71 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.7 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 6.82 112.939 178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 2.25 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 3.8 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.45 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p -67.88 -41.24 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.53 110.5 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -63.32 -17.8 62.93 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.518 1.303 . . . . 3.57 114.518 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 15.9 tt -106.15 -17.02 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.956 1.303 . . . . 7.25 113.998 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -97.13 -31.44 12.47 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.294 -1.504 . . . . 5.6 113.758 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -70.88 6.0 1.73 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.498 2.319 . . . . 6.09 117.15 -171.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.84 7.67 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 128.944 2.898 . . . . 6.69 117.387 -161.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.03 20.75 18.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.96 2.504 . . . . 6.61 114.672 -177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -87.1 8.46 23.54 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.437 1.495 . . . . 14.84 114.311 174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -41.66 131.13 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 127.928 2.491 . . . . 12.38 114.687 -175.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -85.47 21.91 12.24 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 126.695 2.093 . . . . 17.03 115.721 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.12 8.64 0.13 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 128.076 2.55 . . . . 17.69 117.056 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.11 82.2 0.7 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.645 1.978 . . . . 25.63 111.059 170.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -149.73 160.82 43.23 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.292 1.437 . . . . 24.53 113.221 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 50.7 m -70.98 -56.66 5.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.891 0.876 . . . . 29.71 110.409 162.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.78 155.66 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.147 0.979 . . . . 33.62 112.106 -170.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 28.9 mt -79.5 130.78 35.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.628 0.371 . . . . 30.37 111.101 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 61.0 tp -106.54 137.76 43.96 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.818 1.247 . . . . 34.62 112.233 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 130.729 3.611 . . . . 38.73 117.002 174.831 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 115.241 1.571 . . . . 8.2 115.241 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t -64.14 -41.77 97.06 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.79 113.932 -159.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 6.72 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 6.71 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 3.88 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 2.38 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 2.59 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.44 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 2.1 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 3.63 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 4.22 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 3.07 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 4.01 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 3.16 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.65 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.7 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 3.61 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 3.33 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 2.32 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 2.03 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 2.06 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 2.42 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 2.67 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 3.19 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 3.58 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 2.67 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 3.94 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 2.36 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 3.37 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 1.06 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 3.78 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 2.23 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 2.15 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 8.61 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.77 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.8 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.66 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 6.86 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . 0.428 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 4.8 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 3.15 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . 0.428 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 5.06 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 4.34 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 2.11 110.845 -159.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.96 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 3.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 1.07 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 2.33 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.87 111.187 173.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.52 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 4.27 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 4.98 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.6 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 5.71 115.874 -162.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 5.35 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.26 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 4.22 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 3.41 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 3.62 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 2.02 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 2.07 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.23 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.22 112.084 165.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 4.61 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 3.55 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . 0.479 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . 0.479 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 7.2 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.67 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 3.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 5.01 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 3.25 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 7.58 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.5 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 5.16 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 7.01 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.93 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 2.75 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 3.12 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 1.94 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.89 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 2.28 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 2.09 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 3.59 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 3.24 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 4.61 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 1.94 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 7.29 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 2.3 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 2.33 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.28 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 3.23 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 5.69 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.96 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 1.88 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 5.45 112.325 170.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 3.72 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.92 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 2.24 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 3.68 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 5.43 110.115 163.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 8.31 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 2.29 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 3.43 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.66 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.37 -40.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 3.24 111.282 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -60.61 -28.99 68.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.474 0.71 . . . . 2.91 112.109 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.77 -9.0 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 114.855 1.428 . . . . 5.63 114.855 174.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -139.79 -22.55 0.87 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.339 1.427 . . . . 4.73 114.521 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -75.71 -36.5 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.556 1.142 . . . . 8.02 112.259 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.55 -63.96 0.96 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.289 1.436 . . . . 6.24 110.44 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -129.03 131.6 47.39 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.821 2.048 . . . . 8.6 107.861 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -72.44 -41.88 65.66 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.465 0.913 . . . . 13.35 113.465 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 22.0 mm 66.21 -34.72 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 126.417 1.887 . . . . 12.61 115.059 -179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 99.8 69.26 0.89 Allowed Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.512 1.529 . . . . 15.67 113.88 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.82 174.78 11.85 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.677 1.591 . . . . 17.02 112.052 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.58 153.49 28.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.526 1.531 . . . . 22.9 112.224 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -137.72 179.28 6.51 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.724 1.609 . . . . 23.56 110.765 176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.2 p -68.22 -78.76 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.125 -0.984 . . . . 27.34 110.88 169.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 31.1 pt -143.22 152.25 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.776 2.03 . . . . 30.29 110.628 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -148.78 155.75 41.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.599 1.16 . . . . 26.85 112.321 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 38.7 tp -65.03 137.01 57.44 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.75 0.82 . . . . 30.11 111.759 178.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.258 1.552 0 C-N-CA 129.658 3.183 . . . . 33.61 115.147 -174.783 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.8 p30 . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 110.918 -0.03 . . . . 9.15 110.918 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m 50.41 -135.29 1.39 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.98 1.312 . . . . 7.41 111.871 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 5.16 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 7.77 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 3.82 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 2.67 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 3.24 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.69 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.4 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 4.06 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 4.16 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 5.4 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.77 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.53 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.27 113.495 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 2.39 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 4.0 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 3.77 112.166 -176.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 2.39 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 2.19 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.67 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 2.79 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 3.28 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 3.41 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.9 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 2.53 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 3.84 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 2.62 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 3.81 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.98 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.26 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.65 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 4.57 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 2.57 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 3.76 110.412 -164.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 13.2 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.54 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 5.16 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.53 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 7.11 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 4.07 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 3.06 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 5.53 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 3.69 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 2.14 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 4.41 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 2.84 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 2.61 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.58 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 4.72 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 3.26 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 3.8 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 5.58 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 4.07 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.91 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.74 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 3.5 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 3.19 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 2.74 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 2.08 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.49 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.63 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 6.71 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 4.24 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 7.58 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.82 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 3.51 109.031 174.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 4.44 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 4.71 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 7.54 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 4.53 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 4.42 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 10.69 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 4.56 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 3.03 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.89 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 2.96 113.616 -174.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 5.34 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 2.34 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.61 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 3.69 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 2.74 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 5.04 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 2.1 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 7.53 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 2.86 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 3.1 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.48 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 3.63 111.581 171.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 4.31 111.668 170.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 2.15 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 3.74 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 3.93 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.91 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 2.53 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 3.87 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 5.41 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 8.34 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.98 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 4.04 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -86.37 -36.1 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 5.27 111.881 174.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.3 68.24 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.101 0.778 . . . . 5.29 113.101 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 19.1 tt -77.91 -45.26 27.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 118.728 0.694 . . . . 8.08 112.439 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -74.9 -33.75 62.08 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.927 1.455 . . . . 6.72 114.927 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -74.06 -13.81 60.9 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.031 1.332 . . . . 8.29 113.574 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.51 -24.79 15.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.379 1.871 . . . . 8.73 112.086 161.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.6 t0 59.27 173.51 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.96 2.904 . . . . 12.14 113.88 -171.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -68.06 -46.79 70.12 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 120.676 -1.265 . . . . 20.6 112.408 -171.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 18.8 mm 60.58 -34.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 128.208 2.603 . . . . 17.69 115.635 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 80.8 18.12 71.06 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.733 1.159 . . . . 22.31 112.788 -158.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 145.41 47.62 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.969 1.384 . . . . 22.52 112.42 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.95 121.94 15.31 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.671 0.788 . . . . 31.9 110.265 178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -74.87 137.58 41.88 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.21 1.004 . . . . 28.54 110.996 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 60.8 m -67.05 -60.88 2.25 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.081 0.952 . . . . 30.82 112.967 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 42.6 pt -130.62 155.01 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.45 0.7 . . . . 33.57 112.132 -167.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.17 171.66 7.31 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.833 1.253 . . . . 35.88 112.639 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 65.4 tp -134.4 134.61 41.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.495 1.518 . . . . 37.44 110.526 167.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 . . . . . 0 C--O 1.252 1.218 0 C-N-CA 129.102 2.961 . . . . 42.88 114.811 159.035 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 48.7 t30 . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 121.811 0.815 . . . . 8.28 111.698 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p -86.46 -26.56 24.59 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.408 1.083 . . . . 4.5 112.864 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 6.7 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 5.87 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.94 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 2.29 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 2.59 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.92 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 2.01 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 4.26 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 3.62 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 2.91 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 4.21 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.97 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.45 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.99 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 3.55 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 2.59 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 2.12 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 1.76 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.73 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 2.42 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.75 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 5.65 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 3.64 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 3.15 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 3.48 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.464 HG12 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 2.6 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 3.3 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.14 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 4.11 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 2.18 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 3.9 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 8.82 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.96 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 3.27 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 3.57 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 2.01 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.94 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 6.19 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.87 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 5.46 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 3.98 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 2.11 110.673 -162.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 4.57 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 6.08 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 1.97 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 1.94 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.48 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 3.9 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 3.45 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 3.29 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.99 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.4 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 5.4 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.85 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 3.67 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 1.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.69 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.77 111.738 171.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 5.32 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 3.77 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 6.49 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.91 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 4.28 114.224 -164.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 5.75 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.97 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.51 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.72 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 4.29 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 6.14 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 4.27 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 3.19 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 3.19 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 2.29 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 4.24 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 1.93 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 1.73 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.464 ' CE1' HG12 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 4.62 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 3.53 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 6.93 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 2.1 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.83 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 3.22 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 2.46 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.61 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 3.45 111.607 172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 3.42 111.603 172.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.81 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 3.01 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 3.32 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.26 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 3.43 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 3.11 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.89 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 8.33 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 3.02 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 3.7 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.89 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p -86.19 -41.68 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 4.27 111.176 171.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -50.28 -39.16 44.48 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.886 1.274 . . . . 3.39 113.999 -175.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 9.4 tp -76.06 -15.5 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.682 1.593 . . . . 5.45 114.842 -175.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -105.3 -31.33 9.13 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.737 -1.227 . . . . 5.37 111.77 167.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -57.85 -39.73 78.43 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.43 1.892 . . . . 10.11 113.04 177.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -64.66 -15.0 60.62 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.786 1.773 . . . . 7.56 115.786 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -70.66 148.14 48.38 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.188 0.904 . . . . 7.82 113.416 -171.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -95.12 -5.26 44.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.272 2.229 . . . . 14.99 117.015 -164.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.304 0.4 OUTLIER 21.46 -125.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 130.591 3.556 . . . . 12.26 114.672 -169.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -87.38 13.86 59.16 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 124.555 1.074 . . . . 16.64 114.958 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -122.91 -48.21 2.02 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.107 1.151 . . . . 17.8 114.107 -155.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -124.22 -175.41 3.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.84 1.656 . . . . 22.97 111.275 -172.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -108.87 165.76 11.33 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.597 1.159 . . . . 23.19 110.456 173.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.5 m -71.86 -177.98 2.16 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.395 1.078 . . . . 22.74 113.647 -172.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 28.4 pt -61.59 165.79 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.568 1.547 . . . . 25.21 113.959 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.91 134.71 48.71 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.062 0.945 . . . . 27.1 110.804 170.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.38 159.3 23.68 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.13 1.372 . . . . 29.97 113.863 -171.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 72.0 t60 . . . . . 0 C--O 1.257 1.493 0 C-N-CA 128.144 2.578 . . . . 35.44 115.096 -162.166 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 8.7 p30 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 114.372 1.249 . . . . 6.46 114.372 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m 60.44 -17.05 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.8 118.991 168.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.99 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.83 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 3.52 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.87 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 2.32 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 3.04 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.93 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 3.78 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 3.31 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 2.68 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 3.27 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.84 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.57 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 3.12 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 3.71 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 2.74 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 2.33 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 2.14 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 1.67 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 2.01 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 3.54 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 3.94 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.97 113.74 -151.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 3.1 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 3.78 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 2.09 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 3.29 111.583 165.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.7 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.49 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 4.19 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 2.87 114.658 -169.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 2.83 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 10.08 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . 0.477 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . 0.477 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 4.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.99 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.87 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 5.22 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 5.71 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.68 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 3.84 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 4.04 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 1.73 110.92 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 3.93 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 2.12 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 2.07 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.47 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 4.28 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 2.59 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 3.33 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 5.13 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 6.21 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 3.68 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 3.18 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 2.05 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 2.49 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.46 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.2 111.204 164.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 4.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 3.8 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 7.8 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 7.5 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 3.38 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 5.69 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 3.4 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 8.42 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.53 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 4.41 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 9.54 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.95 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 3.0 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 2.75 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 2.42 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.73 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 2.11 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 2.13 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 3.69 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 3.23 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.9 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 1.91 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.83 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 3.63 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 2.35 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 3.04 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 3.59 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 3.66 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 2.06 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 2.67 114.722 176.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 3.88 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.69 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 3.02 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 2.7 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 5.01 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 6.28 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 2.15 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 3.64 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.92 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 4.27 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.01 -33.48 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 3.02 111.754 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.42 -20.59 7.78 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.892 1.277 . . . . 3.48 114.426 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.0 tt -122.15 -34.83 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 125.024 1.329 . . . . 6.85 113.168 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -69.82 -27.46 64.89 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.052 1.341 . . . . 5.81 113.723 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -72.51 -8.89 57.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.807 -1.183 . . . . 6.31 113.85 173.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 18.9 mt -97.63 -56.53 2.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.854 1.661 . . . . 6.02 110.668 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -139.6 127.94 22.72 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.101 1.76 . . . . 7.35 109.614 166.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 42.0 ptt85 -75.61 1.09 15.33 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 116.066 1.876 . . . . 13.68 116.066 -170.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.68 141.29 46.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.801 2.441 . . . . 13.83 111.279 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -84.26 -42.83 7.3 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.329 1.443 . . . . 17.15 115.846 -171.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt 51.11 64.22 1.93 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.498 1.519 . . . . 18.57 114.046 170.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -43.23 159.34 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.169 3.388 . . . . 26.17 116.648 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.29 -34.42 25.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.671 1.588 . . . . 25.46 112.163 176.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 10.0 p -151.7 -60.36 0.17 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.11 1.364 . . . . 29.46 112.908 171.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.6 pt -146.65 167.41 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.485 1.914 . . . . 32.92 110.245 -174.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.6 mt -88.24 159.39 18.15 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.62 0.724 . . . . 30.39 112.303 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 41.0 tp -81.33 122.32 27.32 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.907 0.883 . . . . 33.36 110.75 170.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.256 1.427 0 C-N-CA 127.823 2.449 . . . . 37.99 114.341 165.417 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 121.718 0.77 . . . . 8.74 112.586 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m -75.74 15.35 0.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.82 116.366 -164.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 5.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 5.35 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 3.52 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 2.02 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.81 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 4.35 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.85 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 4.03 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.88 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 3.8 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 3.16 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.43 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 2.0 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.16 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 2.52 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 3.21 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 2.39 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 1.94 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 1.65 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 1.67 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 2.03 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 2.65 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 3.61 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 2.98 113.401 -166.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 3.15 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 3.36 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.97 111.985 175.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 3.52 111.777 168.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.33 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 4.96 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 2.0 112.869 -175.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 3.21 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 9.26 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 3.66 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 4.06 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 5.0 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 5.89 113.519 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.74 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 3.98 111.78 -174.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 3.98 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.88 111.77 -165.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 4.33 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 1.08 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 2.1 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 1.89 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.71 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 4.11 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 2.54 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 3.63 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 6.3 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 5.2 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.481 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 5.11 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 3.05 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 3.2 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 2.16 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 2.18 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.32 111.325 167.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 9.45 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 3.7 115.476 -173.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 7.26 114.386 168.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.8 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.69 114.578 -169.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 4.47 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 3.65 112.859 177.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 8.59 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 3.21 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.77 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 7.53 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 4.56 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 2.77 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 3.22 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 2.38 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.98 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.86 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.95 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 4.42 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 3.24 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.94 108.382 169.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 1.76 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 8.39 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 2.54 108.836 -171.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 3.84 111.984 -176.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 3.92 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 1.81 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 2.88 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 3.17 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.53 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.63 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 3.02 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 7.76 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 5.42 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 2.43 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 4.36 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.84 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p -88.27 -31.47 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 3.32 112.133 177.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.04 63.7 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.586 0.958 . . . . 3.69 113.586 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -75.34 -10.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 114.161 1.171 . . . . 6.58 114.161 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -99.82 -34.15 10.27 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.946 1.699 . . . . 5.86 111.693 169.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -75.49 -2.6 29.65 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.814 1.246 . . . . 9.46 113.578 172.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.3 -24.11 65.72 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.661 1.984 . . . . 6.09 112.852 166.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -61.47 168.49 2.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.511 1.524 . . . . 8.01 114.504 -173.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 41.4 mtm180 -50.05 3.18 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 131.037 3.735 . . . . 11.99 118.407 -174.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 15.4 mm -53.43 111.87 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 126.297 1.839 . . . . 14.3 114.594 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 71.8 -9.47 4.95 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.672 1.606 . . . . 18.23 114.969 -174.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.252 0.0 OUTLIER -114.71 21.39 14.48 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.467 1.907 . . . . 17.67 114.652 178.063 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 50.7 tttm -63.65 136.12 57.26 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.157 1.383 . . . . 22.73 111.01 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 20.2 m120 57.04 -10.54 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.018 2.527 . . . . 22.91 116.395 -173.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 14.7 m -76.45 134.17 39.64 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.114 1.766 . . . . 24.76 112.362 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 7.6 pt 49.83 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 129.034 2.934 . . . . 27.54 117.749 175.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.4 165.33 13.62 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.342 1.857 . . . . 28.82 112.176 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.65 134.61 47.12 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.717 2.007 . . . . 28.56 112.167 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 59.9 t60 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 126.492 1.917 . . . . 34.63 113.186 163.562 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.055 0.761 . . . . 8.22 113.055 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t -55.88 -25.68 43.66 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.94 -1.1 . . . . 4.89 113.543 -178.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 6.98 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 5.4 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 3.73 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.8 111.405 176.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.88 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 3.11 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.19 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 4.49 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 3.52 112.061 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 2.6 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.84 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 2.21 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.96 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 4.55 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 3.46 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 4.06 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 2.36 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 2.16 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 1.82 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 1.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 3.46 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 3.83 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 3.25 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 2.45 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 3.52 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 2.2 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 3.73 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.57 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.13 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 3.95 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 2.26 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 3.42 111.8 -168.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 11.6 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.99 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 5.54 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 5.06 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 6.67 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 5.12 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 2.88 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 4.51 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 3.58 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 1.77 110.761 -165.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 5.16 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.92 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 1.96 109.033 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 1.84 110.818 176.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 3.59 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 3.22 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.49 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.96 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 7.43 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 3.81 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 2.88 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 2.12 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.85 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.28 114.129 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 7.2 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 3.69 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 8.45 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 7.23 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 3.02 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 6.31 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 5.33 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 7.68 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.55 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 8.0 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 6.69 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 5.83 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 2.81 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.35 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 2.1 115.625 -178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 5.91 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 1.85 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 1.78 110.186 -167.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 4.31 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.86 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.79 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 1.87 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.68 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 3.4 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 2.56 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 2.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.54 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 4.33 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.76 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 3.34 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 3.48 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.38 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 2.68 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 2.93 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.75 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 8.89 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.63 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 4.58 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.73 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.66 -34.47 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.86 110.851 177.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.34 60.8 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.812 1.412 . . . . 4.01 114.812 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.6 tt -95.25 -20.85 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.9 1.28 . . . . 5.36 113.376 173.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -95.05 -31.85 13.4 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.772 -1.205 . . . . 5.36 113.59 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -73.22 -1.07 16.25 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.214 2.206 . . . . 6.62 112.625 168.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.5 tp -102.21 -65.98 0.95 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.967 2.507 . . . . 5.89 112.597 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -102.23 159.8 15.09 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.707 1.203 . . . . 6.75 112.227 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.82 -43.65 9.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.064 0.946 . . . . 12.93 111.613 168.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 26.9 mm 61.46 -45.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 128.795 2.838 . . . . 11.83 114.23 -170.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 170.86 -90.61 0.09 OUTLIER Glycine 0 CA--C 1.528 0.894 0 C-N-CA 129.655 3.502 . . . . 14.46 106.762 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt 59.07 156.53 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 129.844 3.258 . . . . 17.2 116.179 173.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -157.74 144.48 17.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.196 2.198 . . . . 24.87 109.764 175.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -156.34 146.15 21.06 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.217 0.821 . . . . 25.14 113.217 -172.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 83.7 p -68.13 177.44 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.07 1.348 . . . . 28.65 114.264 176.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.5 159.43 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.849 1.66 . . . . 34.57 113.45 -170.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 61.0 tp -100.86 108.02 19.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.58 1.552 . . . . 32.9 109.522 175.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.77 168.13 14.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.781 1.232 . . . . 37.96 112.872 -171.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.57 1.948 . . . . 43.4 112.665 -177.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 120.794 0.33 . . . . 9.37 111.672 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p -75.64 35.86 0.13 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 4.04 116.471 -160.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 5.46 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 5.35 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 3.45 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 2.37 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.45 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.9 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 3.23 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 3.13 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 3.64 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 3.71 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.96 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 3.56 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 2.04 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.26 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 2.55 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 3.41 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 3.94 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.78 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 1.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 2.2 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 2.21 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 3.1 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 5.78 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 3.14 110.056 -173.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.84 111.937 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 4.79 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 2.28 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 3.3 111.666 168.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.83 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.38 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 4.01 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 2.01 115.409 -160.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 2.1 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 8.44 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.65 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 3.55 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 3.35 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.99 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 5.56 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.86 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 3.12 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 3.74 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 3.98 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 2.33 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.36 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 3.94 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.41 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 2.14 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 1.94 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.37 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 3.54 107.812 -141.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 2.86 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 3.08 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 6.03 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.79 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.521 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 5.71 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 3.17 110.33 162.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 3.39 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 2.15 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.75 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.85 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.77 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.43 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 3.62 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.68 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 7.21 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 2.87 114.574 167.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.79 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.57 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 7.51 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.72 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.71 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 6.65 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 4.06 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.49 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 3.36 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.96 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 5.32 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 2.15 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.93 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 5.34 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 3.65 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 4.42 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 2.48 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.93 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.99 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 4.21 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.87 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 3.99 109.584 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 3.9 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 3.76 109.447 168.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 1.94 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 3.12 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 3.51 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.39 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 3.33 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 2.82 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.69 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 8.17 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 2.27 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 3.42 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.91 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.86 -33.81 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 4.32 111.945 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -61.22 -10.29 6.45 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.59 1.33 . . . . 4.03 114.59 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 8.1 tp -115.04 -33.34 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.365 1.466 . . . . 6.33 112.978 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.57 -31.1 71.97 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 120.507 -1.37 . . . . 6.41 113.532 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -90.26 -15.76 30.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.629 2.371 . . . . 9.27 113.201 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 10.0 tt -80.87 -41.11 23.66 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.372 1.469 . . . . 7.28 112.637 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -150.26 145.64 26.32 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.228 -0.92 . . . . 9.19 111.911 170.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -84.4 -20.05 32.51 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.128 1.371 . . . . 16.13 114.109 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 24.3 mm 63.15 -33.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 128.737 2.815 . . . . 15.09 117.258 172.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 102.6 28.49 6.3 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 125.882 1.706 . . . . 19.71 112.806 -156.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -136.4 166.81 22.61 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.151 1.78 . . . . 20.23 111.899 -178.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -154.23 101.88 2.42 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.48 1.112 . . . . 27.4 111.93 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.26 -24.41 32.3 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.534 2.334 . . . . 25.92 112.769 178.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -62.86 166.85 5.17 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.457 1.103 . . . . 27.88 113.89 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 14.6 pt -69.78 151.73 9.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 125.23 1.412 . . . . 33.28 114.402 -166.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.06 9.3 24.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.912 1.685 . . . . 35.38 113.669 171.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -81.44 113.0 19.21 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.131 1.372 . . . . 38.83 109.144 176.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 127.089 2.155 . . . . 42.67 114.421 -179.597 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 113.473 0.916 . . . . 8.89 113.473 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -76.05 -15.0 60.2 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 -167.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 5.85 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 4.35 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 3.08 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 2.0 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.81 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.88 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.92 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 3.88 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 3.53 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 2.26 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 2.16 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.78 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 3.2 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 2.56 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 2.16 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 1.77 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 2.49 114.512 171.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 1.91 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 3.08 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 3.24 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 3.45 112.311 -157.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 4.44 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 4.34 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 2.38 111.776 178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 3.14 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.55 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 5.31 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 2.21 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 2.23 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 8.18 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.76 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 3.74 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.89 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.55 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 5.87 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 8.02 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 3.21 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 6.02 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 3.83 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 2.07 111.458 -170.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 3.8 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.31 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 2.05 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 1.98 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.35 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.92 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 3.44 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.87 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 5.67 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 5.48 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 4.0 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.87 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 3.45 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 2.32 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 3.59 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 5.14 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 3.67 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 9.23 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 7.06 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 3.18 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 5.46 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 5.32 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.76 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.79 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 5.32 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 8.24 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 4.9 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 2.43 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 3.67 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.98 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 6.05 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.8 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 2.02 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 3.88 108.577 170.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 3.63 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.87 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 2.37 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.74 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 2.49 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 2.25 111.062 -177.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.65 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 3.04 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.41 112.775 174.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 3.85 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 2.19 112.633 -172.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 3.12 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 3.35 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.62 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.88 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 3.38 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 7.33 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 7.66 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 2.59 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 3.76 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.79 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p -59.34 -36.37 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 4.02 111.02 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.69 -1.73 0.93 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.934 1.828 . . . . 4.62 115.934 173.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.1 tt -127.78 -28.05 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.155 1.382 . . . . 5.97 113.006 166.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -65.57 -38.05 88.43 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.94 -1.725 . . . . 4.03 112.751 172.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -82.36 -15.57 52.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.614 1.966 . . . . 5.91 113.413 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -93.23 -7.56 44.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.46 1.504 . . . . 7.4 112.698 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 29.8 t0 61.36 173.09 0.11 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.783 2.033 . . . . 9.72 114.189 -172.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -51.9 -60.81 2.75 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.341 1.856 . . . . 14.15 112.793 -175.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 33.6 mm 58.02 147.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.768 2.427 . . . . 16.16 113.464 -175.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -72.23 96.12 0.7 Allowed Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.731 -1.231 . . . . 20.03 110.615 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -91.81 151.96 20.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.886 0.843 . . . . 22.31 112.774 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -82.98 163.91 20.73 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.898 1.279 . . . . 28.52 112.126 165.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -62.18 -47.82 82.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.559 0.948 . . . . 29.34 113.559 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 69.0 m 54.44 -161.04 0.15 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.945 1.298 . . . . 30.31 114.337 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 38.6 pt -69.98 157.63 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.189 2.195 . . . . 32.67 114.356 -170.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.62 178.07 8.39 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.995 0.918 . . . . 35.91 113.046 174.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -142.77 125.0 15.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.08 0.952 . . . . 34.81 110.641 166.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 36.2 t60 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 128.021 2.529 . . . . 40.69 114.658 176.042 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 113.866 1.061 . . . . 9.81 113.866 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t -53.68 -41.87 67.34 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.352 -0.842 . . . . 3.86 113.084 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 5.13 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 4.66 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 4.24 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 2.01 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 2.19 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.95 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.67 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.47 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 3.54 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 3.45 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 2.93 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 2.04 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.13 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 2.25 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 3.15 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 2.38 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 1.96 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.92 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 2.53 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 2.18 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.86 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 6.1 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 3.62 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 2.87 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 3.75 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 1.87 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 3.25 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.43 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 3.9 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 2.11 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.81 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 9.6 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.84 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 3.04 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.86 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 4.61 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 4.29 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 2.81 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 3.8 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 4.93 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.7 110.287 -161.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 3.83 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 1.21 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 1.95 108.117 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 2.0 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.25 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 3.71 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 2.34 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.78 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 7.26 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 4.28 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.73 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 7.24 116.306 -168.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 2.2 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 3.32 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 2.69 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.99 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.45 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.26 111.852 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 5.4 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 4.07 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 3.05 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . 0.445 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . 0.445 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.87 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 8.35 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 4.54 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 4.47 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.9 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 11.32 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.99 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 4.53 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 8.71 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 4.26 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 3.15 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 2.58 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 2.06 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 5.21 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 2.12 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 2.22 109.306 -175.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 4.86 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 3.13 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 4.08 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 1.82 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.3 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 2.25 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 2.24 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.63 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 3.63 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 3.68 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.3 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 2.13 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 2.66 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 3.69 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 2.07 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 3.46 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 3.32 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 5.5 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 6.0 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.78 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 3.6 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 5.56 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -104.53 -36.42 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.95 111.745 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.1 65.51 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.044 1.128 . . . . 4.92 114.044 175.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.1 tt -77.69 -17.98 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.081 1.352 . . . . 8.84 113.369 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -119.53 -39.86 2.84 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.437 1.495 . . . . 7.32 113.563 -158.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 39.0 ptt85 -68.91 -26.32 65.04 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 115.729 1.751 . . . . 9.26 115.729 -170.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.1 tp -98.97 -41.02 7.77 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.832 0.853 . . . . 6.97 113.297 -158.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -66.03 159.06 26.74 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.36 0.874 . . . . 11.96 113.36 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -67.18 7.81 0.37 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.037 2.935 . . . . 15.05 117.883 -161.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 21.3 mm -80.77 143.2 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 125.873 1.669 . . . . 13.66 109.625 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -75.09 120.5 6.23 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.261 1.41 . . . . 14.41 111.725 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -93.48 128.37 39.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.978 0.911 . . . . 15.13 111.09 -169.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -71.07 -29.51 65.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.981 0.809 . . . . 23.51 112.749 176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -67.02 127.76 33.8 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.406 1.482 . . . . 21.12 112.368 174.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 49.0 m -85.41 -169.22 2.54 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.202 1.401 . . . . 22.81 112.677 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.4 pt -65.76 152.66 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 120.68 -1.262 . . . . 26.76 113.033 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 55.4 tp -80.48 140.79 35.74 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.328 1.451 . . . . 26.87 111.524 -177.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.501 ' CD1' ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -145.44 -179.77 6.88 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.172 1.789 . . . . 32.24 111.165 -177.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.501 ' H ' ' CD1' ' A' ' 671' ' ' LEU . 8.1 t60 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 126.916 2.086 . . . . 37.66 111.678 173.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 116.466 2.024 . . . . 9.53 116.466 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.37 -33.65 71.45 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.432 -1.417 . . . . 4.06 113.866 -179.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 5.21 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.64 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 3.5 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.94 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 2.21 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 3.13 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.83 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 4.62 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 3.55 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 2.6 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 3.74 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 2.33 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.28 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.62 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 3.43 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 2.26 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.92 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 1.81 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 1.94 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 2.23 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.99 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' LYS . . . . . 0.433 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 3.22 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.462 HD12 ' H ' ' A' ' 561' ' ' LYS . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 3.43 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' LYS . . . . . 0.462 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.94 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 3.73 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' VAL . . . . . 0.481 HG12 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 1.98 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 4.11 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 3.93 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.98 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 2.3 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 8.5 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 3.84 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 3.29 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 2.1 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 5.22 113.056 -167.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.87 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 3.39 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 4.34 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 3.66 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.93 109.627 -172.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 4.26 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.38 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 2.31 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.86 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.71 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.94 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 3.55 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.41 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 6.66 115.87 -161.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.85 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.83 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.57 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 3.41 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 2.76 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 2.51 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.84 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.64 110.583 160.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 5.19 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 4.1 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 8.41 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 4.14 112.898 -164.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 7.8 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 5.27 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 9.01 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.78 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 7.46 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 3.56 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 2.32 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 2.55 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 1.97 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 4.1 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.98 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.92 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 627' ' ' TYR . . . . . 0.481 ' CE1' HG12 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 4.66 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 3.48 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 5.58 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 2.45 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.53 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 3.0 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 3.85 112.02 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.72 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 2.66 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 4.4 111.438 175.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 2.02 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 3.71 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 3.55 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.84 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 2.58 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 3.11 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 5.02 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 6.42 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.65 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 4.0 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.55 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.51 -36.66 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 4.08 111.706 173.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -69.07 7.18 0.76 Allowed 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.073 1.508 . . . . 3.9 115.073 177.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 21.3 tt -127.84 -40.25 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.127 0.971 . . . . 5.75 112.6 158.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -58.87 -38.13 78.1 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 120.13 1.332 . . . . 4.64 112.629 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 -75.22 -5.57 45.2 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.186 1.794 . . . . 7.35 113.616 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -100.3 -9.01 22.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.453 1.501 . . . . 7.06 113.3 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.53 -160.85 0.23 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.753 1.221 . . . . 7.75 112.268 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -64.66 -13.77 55.38 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 119.347 -2.096 . . . . 12.64 115.297 -173.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.261 2.6 pp -82.74 -10.86 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 114.107 1.151 . . . . 11.31 114.107 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -71.91 94.68 0.61 Allowed Glycine 0 CA--C 1.533 1.185 0 N-CA-C 109.975 -1.25 . . . . 13.86 109.975 162.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -140.47 25.05 2.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.523 1.675 . . . . 16.3 115.523 -158.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -56.75 -36.66 70.03 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.846 1.259 . . . . 24.38 113.735 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -152.63 142.53 22.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.02 0.928 . . . . 22.7 112.288 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.1 t -83.43 -59.04 2.58 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.264 0.625 . . . . 23.03 112.592 173.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.4 pt -140.69 162.02 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.206 1.403 . . . . 28.5 112.921 -167.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -150.2 165.54 32.59 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.886 1.069 . . . . 28.6 113.886 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -66.47 158.12 30.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.498 1.519 . . . . 34.76 113.271 -175.298 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 672' ' ' HIS . . . . . 0.409 ' H ' HD13 ' A' ' 671' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 128.757 2.823 . . . . 37.42 113.359 170.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 116.017 1.858 . . . . 3.82 116.017 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 6.48 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.32 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 3.78 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 1.55 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 2.5 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.49 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 3.49 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.16 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 2.39 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 3.26 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 3.97 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 1.87 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.25 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 2.8 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 1.49 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 1.17 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 1.1 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 1.14 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 1.31 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 1.85 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 2.61 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 2.71 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 1.83 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 2.85 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.443 HG11 ' CE1' ' A' ' 627' ' ' TYR . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 0.99 111.793 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 2.31 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.47 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 3.18 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 1.24 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 2.51 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 9.79 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 3.28 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 3.65 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 1.92 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 4.47 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 4.48 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.24 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 2.37 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 2.91 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.419 HD11 ' CE2' ' A' ' 607' ' ' PHE . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 1.01 111.885 -159.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 2.82 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.88 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 1.11 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 1.07 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.4 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 591' ' ' VAL . . . . . 0.443 HG13 ' HB2' ' A' ' 599' ' ' MET . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 2.5 107.743 -140.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 2.49 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.47 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 594' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.35 114.664 -169.611 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.78 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 5.45 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 599' ' ' MET . . . . . 0.443 ' HB2' HG13 ' A' ' 591' ' ' VAL . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 2.65 110.739 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 2.84 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 1.57 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 1.83 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.404 ' HB2' HD12 ' A' ' 584' ' ' ILE . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.46 113.502 175.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 6.15 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 607' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 584' ' ' ILE . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 2.3 113.835 175.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 7.84 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 5.73 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.764 HD23 HG22 ' A' ' 635' ' ' VAL . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.43 113.349 174.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 4.82 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 4.81 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 6.89 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.32 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 3.62 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 5.63 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 3.44 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 2.17 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.11 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 1.51 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 4.87 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 1.16 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.01 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.443 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 3.84 106.921 164.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 1.96 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 3.58 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 1.04 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.24 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 2.07 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 2.33 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.03 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.764 HG22 HD23 ' A' ' 612' ' ' LEU . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 2.59 110.89 -174.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.437 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 3.01 109.322 161.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 1.49 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 2.61 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 2.51 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.49 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 2.84 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 2.51 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 3.88 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 5.3 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 2.75 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 3.63 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 4.88 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.47 112.493 176.148 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 114.661 1.356 . . . . 4.08 114.661 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 3.79 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.25 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 2.42 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.11 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 1.43 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 2.79 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 1.87 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 2.41 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 2.13 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 1.6 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.76 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 0.98 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.06 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 1.8 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 1.83 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 1.34 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 0.97 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 0.81 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 0.84 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 0.94 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 1.88 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 2.67 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 2.4 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 1.83 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 2.35 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.505 HG11 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 0.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 1.85 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.89 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 2.3 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.419 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 0.87 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 1.46 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 7.42 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.02 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 3.2 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.09 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 4.24 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 3.42 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 1.96 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 2.4 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 2.78 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 605' ' ' SER . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 0.81 110.336 -166.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 2.99 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.75 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 0.76 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 0.66 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.06 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 591' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 599' ' ' MET . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 2.57 107.628 -142.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 1.54 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.18 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.0 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.58 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.498 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.498 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 4.39 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 599' ' ' MET . . . . . 0.465 ' O ' HG12 ' A' ' 591' ' ' VAL . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 1.68 111.825 -169.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 1.91 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 0.97 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 1.65 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.09 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.471 ' HB2' HD12 ' A' ' 584' ' ' ILE . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.91 111.862 172.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 3.55 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 2.3 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.0 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 7.26 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.433 HD11 ' CD1' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 3.24 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 4.43 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 3.55 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 6.38 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.82 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.1 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 10.33 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.01 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.45 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 3.33 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 0.89 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.2 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 0.77 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 0.97 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.505 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 3.17 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 2.47 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 4.4 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 0.86 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 7.52 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.22 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 1.5 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.16 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 1.86 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.433 ' CD1' HD11 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 2.54 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 0.92 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 2.97 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 2.19 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.66 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 1.89 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 1.63 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 5.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 6.66 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.06 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 2.76 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.19 111.755 176.542 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 7.6 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 7.26 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 2.23 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 1.73 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.01 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.45 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.45 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.07 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 2.41 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 2.37 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 1.94 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 2.75 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.06 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' A' ' 553' ' ' VAL . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.35 113.962 -177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 1.88 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 2.59 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 550' ' ' PRO . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 2.59 112.498 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 0.95 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 0.74 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.15 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 0.99 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 1.87 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 2.54 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.51 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 2.17 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 561' ' ' LYS . . . . . 0.51 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.01 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 2.32 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 0.79 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 2.43 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.19 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 3.44 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.427 HD12 ' CZ ' ' A' ' 607' ' ' PHE . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 1.57 112.737 -173.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 2.8 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 9.24 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 4.69 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.13 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 2.55 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 2.49 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 1.88 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 4.83 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 6.12 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.37 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 2.71 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 3.45 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 1.03 109.639 -155.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 2.27 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 1.38 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 0.95 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 2.6 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 2.2 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 2.8 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.23 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 4.76 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 4.78 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 2.27 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 2.19 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 1.51 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.47 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.62 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.36 111.963 170.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 3.93 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 607' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 571' ' ' ILE . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 3.13 110.36 176.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.77 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 5.33 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 5.47 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 3.21 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 3.83 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.34 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.05 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.1 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 5.37 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 7.39 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.07 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 2.35 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 1.97 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 0.88 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 5.16 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 0.82 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.11 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 3.0 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 2.21 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 2.92 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 1.13 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.01 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 2.69 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 1.48 106.236 174.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 2.55 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 2.63 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 1.57 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 2.2 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 2.7 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.46 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 1.69 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 2.04 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 6.42 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 5.46 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 1.46 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 2.07 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.54 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.47 111.201 -174.119 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.546 0.824 0 N-CA-C 114.914 1.45 . . . . 3.62 114.914 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 3.9 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 4.58 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 3.55 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 1.9 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.56 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 4.59 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 2.97 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.27 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 2.68 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 2.86 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 2.46 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 2.93 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 1.69 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.76 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.28 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 2.08 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 1.91 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 1.14 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 0.81 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.12 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 1.31 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.0 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.08 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.452 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 2.18 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 1.89 112.611 -173.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 2.84 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.535 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 1.04 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 2.18 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.1 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.24 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 2.36 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.34 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 1.83 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 8.17 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.03 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.24 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 3.22 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.26 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.23 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 3.43 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 2.55 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 2.84 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 3.31 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 0.88 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 2.56 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 0.98 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 0.75 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 0.72 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 2.79 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 2.55 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.34 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 594' ' ' LYS . . . . . 0.415 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.12 110.287 172.265 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 6.62 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 4.99 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 2.8 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 1.71 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 1.24 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 1.81 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.3 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 3.86 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 2.24 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.21 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 6.22 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.492 HD23 ' HB ' ' A' ' 635' ' ' VAL . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 3.06 115.96 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.06 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 2.86 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 8.04 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 2.88 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 3.9 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 6.44 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 4.09 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 2.17 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.18 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 1.05 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 3.71 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 0.81 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 0.86 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.535 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 3.11 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 2.27 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 2.81 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 0.87 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 6.6 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.14 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 1.27 110.438 -170.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.492 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 1.87 111.28 -172.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' A' ' 612' ' ' LEU . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 2.49 111.468 175.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 0.97 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 2.34 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 2.23 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 1.99 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 648' ' ' MET . . . . . 0.526 ' HA ' ' HB3' ' A' ' 651' ' ' ALA . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 2.69 110.787 -177.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 4.84 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 5.91 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 651' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 648' ' ' MET . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 2.09 112.961 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 2.41 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.02 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.04 112.622 178.381 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 3.78 116.899 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 5.63 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 5.92 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 2.16 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.17 111.097 172.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 1.56 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 2.95 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.64 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.72 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 3.39 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 2.41 112.337 -178.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 1.67 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 2.85 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.477 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 1.1 114.466 -168.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.43 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 2.48 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 2.3 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.477 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 1.57 112.134 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 1.54 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 1.13 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 0.76 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 1.16 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 2.87 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 2.74 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 2.67 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 2.86 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 2.13 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 0.84 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 2.14 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.9 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 2.49 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.07 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 1.65 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 7.44 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 2.7 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.05 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.65 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 7.35 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 3.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.25 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 3.04 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 2.81 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 0.78 111.463 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 2.6 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.23 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 0.92 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 0.7 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.13 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 2.52 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 2.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.33 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 4.5 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 3.88 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 3.59 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.1 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 1.87 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 2.19 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 0.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 1.66 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.12 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.85 112.392 174.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 3.63 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 2.27 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 5.8 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 5.09 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.785 HD23 HG22 ' A' ' 635' ' ' VAL . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 2.17 115.331 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 4.3 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 3.49 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 7.95 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 1.91 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 3.71 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 6.38 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 3.14 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 1.64 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.58 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 0.92 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 4.69 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 0.72 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 0.86 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 3.21 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.09 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 3.96 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 1.04 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.25 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 1.98 113.364 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 1.38 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.785 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 2.62 110.902 176.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 2.94 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.2 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.06 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 2.42 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.67 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 1.79 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 1.88 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 4.79 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 5.28 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 1.52 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 2.49 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 2.55 113.068 -179.051 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 121.245 0.545 . . . . 7.99 112.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 6.1 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.17 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 2.89 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.473 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 1.16 111.43 177.34 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 1.59 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.61 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 1.91 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 2.45 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' PHE . . . . . 0.473 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 2.25 113.448 175.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 1.64 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 2.73 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 1.04 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.08 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.03 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 2.15 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 1.42 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 0.9 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 0.73 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.1 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 0.96 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 1.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 2.8 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 2.63 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 3.25 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 2.95 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.56 HG11 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 1.24 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.43 ' CD2' HG22 ' A' ' 571' ' ' ILE . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 2.51 111.316 167.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 2.31 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.43 HG22 ' CD2' ' A' ' 565' ' ' PHE . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 1.34 113.119 -169.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 1.82 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 7.3 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 3.91 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 2.83 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 2.33 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.75 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 4.42 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.02 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 1.74 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 2.92 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 2.52 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.527 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 0.84 110.699 -164.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.03 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.06 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 1.27 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 0.82 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 591' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 599' ' ' MET . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 2.62 108.582 -138.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 2.68 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.05 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 5.87 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.38 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 3.86 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 599' ' ' MET . . . . . 0.451 ' O ' HG12 ' A' ' 591' ' ' VAL . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 1.87 112.14 -169.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 2.33 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 0.94 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 3.46 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.527 ' HB2' HD12 ' A' ' 584' ' ' ILE . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 0.94 112.688 175.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 3.41 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 2.23 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 8.3 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 5.13 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 635' ' ' VAL . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.25 114.005 -163.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 5.4 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 3.86 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.08 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.03 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 3.46 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 6.43 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 4.7 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 1.87 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.22 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 1.13 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 4.2 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.16 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 1.4 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.56 ' CE1' HG11 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 4.08 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 2.51 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 4.49 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.27 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.15 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 2.76 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 1.38 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 2.63 111.007 173.521 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.57 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 2.76 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 1.06 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 2.09 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 2.35 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.28 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 1.81 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 1.53 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 4.84 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 5.6 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 1.75 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 2.48 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 3.35 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 2.74 111.202 174.569 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 4.39 114.64 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.34 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.03 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 2.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 1.21 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 1.53 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 2.73 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 2.81 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.12 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.06 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 2.31 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 1.79 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 2.96 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 1.05 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.19 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 3.04 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 2.35 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 1.5 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 1.09 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 0.9 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 1.09 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 1.14 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 3.08 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.09 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 2.42 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 2.72 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 2.59 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 0.98 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.484 ' CG ' HG22 ' A' ' 571' ' ' ILE . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 2.18 111.139 169.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 3.25 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.39 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 2.73 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.484 HG22 ' CG ' ' A' ' 565' ' ' PHE . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 0.93 114.683 -163.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 1.5 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 7.21 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.75 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 4.25 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 2.95 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.08 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 4.61 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 3.49 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 1.74 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 3.16 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 2.51 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.13 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 4.35 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.01 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 0.88 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 0.94 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.37 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 591' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 599' ' ' MET . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 2.96 108.616 -137.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 2.17 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.07 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 3.96 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.43 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.561 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.561 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 4.17 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 599' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 591' ' ' VAL . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.36 113.075 -167.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.11 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 1.88 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.52 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.05 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 3.62 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 2.01 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.35 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 5.7 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.04 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.439 HD21 ' CG ' ' A' ' 638' ' ' PHE . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 2.51 113.103 -162.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 3.9 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 3.79 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 12.23 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 3.5 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 3.46 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.09 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 5.38 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 2.23 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.03 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 1.41 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 4.68 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 0.98 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 1.3 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 4.07 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 2.79 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 4.36 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 1.08 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 6.8 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 1.62 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 1.53 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.421 ' HB ' HD22 ' A' ' 612' ' ' LEU . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 1.87 112.092 174.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.439 ' CG ' HD21 ' A' ' 612' ' ' LEU . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 2.66 111.98 163.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 1.2 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 2.74 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 2.19 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.64 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 2.81 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 1.79 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 5.71 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 5.91 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.01 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.12 111.644 179.878 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.07 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 537' ' ' LYS 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 6.79 113.887 167.295 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 2.51 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.459 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 1.29 110.703 173.754 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 1.82 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.38 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 1.95 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 2.87 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' PHE . . . . . 0.459 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 2.69 112.999 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 1.52 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 2.69 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.453 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 1.32 114.057 -170.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.25 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 1.87 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 1.86 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.453 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 1.73 111.691 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 1.74 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 1.17 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.12 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 560' ' ' LEU . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 1.47 114.06 -165.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 2.19 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 3.21 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 557' ' ' LEU . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 2.76 112.064 -167.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.03 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 2.74 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 0.95 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 2.15 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 2.59 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 1.14 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 1.57 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 7.83 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 2.69 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 3.02 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 1.84 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 3.97 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 4.94 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 2.58 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 2.99 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 2.67 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 605' ' ' SER . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 0.92 111.284 -161.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.6 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 3.99 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 0.95 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 0.99 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 0.98 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.54 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 3.46 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 1.97 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 3.37 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 594' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 6.39 117.7 -162.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 4.87 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.48 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 3.62 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 2.39 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 2.61 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 0.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 1.74 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.457 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.01 111.429 170.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 5.78 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 2.52 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 5.73 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 5.4 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.776 HD23 HG22 ' A' ' 635' ' ' VAL . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.01 112.946 -167.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 613' ' ' LEU . . . . . 0.665 ' H ' HD13 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 3.37 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 2.98 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 7.03 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.36 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 5.02 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 5.64 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.13 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 1.53 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 1.93 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 1.09 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 3.72 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 0.99 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 1.12 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 3.41 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 2.76 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 2.92 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.07 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 7.47 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.4 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 1.35 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 2.47 112.19 -174.495 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 2.4 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.15 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.01 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 2.3 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.48 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 1.74 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 1.72 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 4.56 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 5.38 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 1.72 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 2.16 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.53 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 2.56 112.137 174.987 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 112.583 0.586 . . . . 3.33 112.583 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 5.64 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 3.71 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 2.44 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 1.84 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.12 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.52 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.42 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.46 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 2.81 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 2.62 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 1.82 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 4.68 113.705 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 1.27 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.28 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 2.26 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 2.34 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 1.91 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 1.32 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 0.77 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' MET . . . . . 0.549 ' HB3' HG11 ' A' ' 641' ' ' VAL . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 1.77 115.459 174.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 1.57 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 1.88 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 2.62 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.408 HD13 ' HG ' ' A' ' 633' ' ' LEU . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 2.58 114.135 -159.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 1.97 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 2.82 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 2.67 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 0.83 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 2.15 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.21 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 2.78 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.412 HD11 HG13 ' A' ' 622' ' ' VAL . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 1.42 115.626 -167.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.56 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 10.42 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.62 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.71 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 3.77 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 2.49 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 1.94 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.1 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 3.43 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 1.83 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 2.38 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 2.52 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 605' ' ' SER . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 0.74 111.575 -164.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.8 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 2.43 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 1.1 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 1.01 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.68 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 3.05 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 1.61 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 2.49 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 4.5 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 3.86 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.403 ' H ' ' HE2' ' A' ' 597' ' ' LYS . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.39 112.125 177.047 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 2.12 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.06 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 1.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.62 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.496 ' HB2' HD12 ' A' ' 584' ' ' ILE . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.07 111.551 167.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 3.43 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 2.36 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 7.63 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 6.53 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.482 HD22 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 2.55 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 3.51 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.2 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 10.6 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 2.45 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 4.26 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 4.9 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 3.24 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 1.8 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.07 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 622' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 571' ' ' ILE . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.03 114.437 -172.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 4.74 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 0.97 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.14 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.575 ' CE1' HG11 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 3.89 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 2.42 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 4.72 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 0.77 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.14 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 1.79 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.408 ' HG ' HD13 ' A' ' 560' ' ' LEU . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 1.63 110.821 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.0 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.462 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 1.74 111.453 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 637' ' ' ASN . . . . . 0.577 ' O ' HG12 ' A' ' 641' ' ' VAL . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.482 ' CG ' HD22 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 2.75 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 641' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 637' ' ' ASN . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 1.39 113.23 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 2.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 2.34 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.52 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 1.65 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 1.6 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 4.45 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 4.34 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.1 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 2.65 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 3.76 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.57 112.241 -174.196 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 113.856 1.058 . . . . 3.35 113.856 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 4.79 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 4.64 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 2.96 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.414 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.41 110.383 169.68 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.03 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 3.91 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 2.55 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.74 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 2.68 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' PHE . . . . . 0.414 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 2.56 114.153 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 2.17 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 3.77 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 1.25 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.44 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 2.43 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 2.21 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 1.78 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 1.36 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 0.87 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 0.84 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 0.89 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 2.56 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 2.71 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.455 HD13 ' HG ' ' A' ' 633' ' ' LEU . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 2.28 111.512 -165.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 2.68 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 2.87 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 0.97 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 2.07 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 2.8 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 1.05 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 1.8 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 6.92 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.42 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 2.86 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 2.42 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.27 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 5.15 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 4.77 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.33 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 3.41 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 2.9 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' A' ' 605' ' ' SER . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 0.85 110.442 -168.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 2.38 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 0.89 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 0.89 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 0.68 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.26 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 3.16 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 2.1 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.28 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.14 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 3.97 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.578 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.578 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 4.33 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 1.92 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 2.06 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 1.12 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.51 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.54 ' HB2' HD12 ' A' ' 584' ' ' ILE . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.05 111.867 173.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 3.45 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 2.28 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 610' ' ' ILE . . . . . 0.428 HG22 HG22 ' A' ' 614' ' ' THR . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 5.54 110.996 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 5.18 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 2.23 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 4.84 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 614' ' ' THR . . . . . 0.428 HG22 HG22 ' A' ' 610' ' ' ILE . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 3.21 109.441 173.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 7.85 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 2.46 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 5.78 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 7.27 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 4.84 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 2.21 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 2.78 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 1.13 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.02 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 0.97 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 0.95 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 2.65 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 2.23 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.1 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.01 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.07 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 1.77 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.455 ' HG ' HD13 ' A' ' 560' ' ' LEU . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 1.39 109.871 -174.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.25 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 2.09 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 2.67 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.32 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 2.18 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 2.37 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.32 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 1.52 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 1.6 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.08 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 650' ' ' ARG . . . . . 0.408 ' HA ' ' HG2' ' A' ' 653' ' ' GLU . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 5.7 112.939 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 1.82 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 2.64 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 653' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 650' ' ' ARG . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.4 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.07 110.5 171.613 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.55 113.932 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 5.75 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 5.66 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 2.87 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 1.33 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 1.83 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.03 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 1.87 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 2.53 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 2.93 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 2.04 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 3.71 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 2.0 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.43 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.19 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 2.27 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 2.35 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 1.6 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 1.07 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 1.05 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 1.18 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 1.89 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 2.48 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 2.74 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 1.9 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 2.77 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 1.33 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 2.16 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 0.98 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 2.52 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 1.4 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 1.51 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 7.85 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.07 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.02 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.29 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 5.9 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 580' ' ' LYS . . . . . 0.457 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 3.81 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 2.8 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 582' ' ' TYR . . . . . 0.457 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 3.68 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 3.19 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 605' ' ' SER . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 0.95 110.845 -159.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.79 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 2.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 0.98 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 1.1 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.42 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.11 111.187 173.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.37 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 3.13 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 3.67 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.04 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 594' ' ' LYS . . . . . 0.501 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 4.72 115.874 -162.046 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 4.58 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.25 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 3.59 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 2.43 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 2.67 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 1.1 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 1.59 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.2 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.04 112.084 165.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 3.69 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 2.23 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 609' ' ' GLU . . . . . 0.549 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 610' ' ' ILE . . . . . 0.549 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 6.13 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.13 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 2.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 4.02 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 2.89 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 6.68 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.2 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 4.41 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 6.19 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.08 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 1.78 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 2.47 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 0.96 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.21 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 0.99 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 625' ' ' ASP . . . . . 0.42 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 1.13 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 2.56 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 2.53 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 3.46 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 0.92 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 6.48 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 1.81 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 1.35 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.05 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 2.2 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 4.17 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.89 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 0.94 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 642' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 649' ' ' ARG . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 4.32 112.325 170.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 2.32 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.79 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 1.62 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 2.55 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 649' ' ' ARG . . . . . 0.403 ' HA ' HD21 ' A' ' 642' ' ' LEU . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 4.79 110.115 163.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 7.0 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 1.91 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 2.28 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.55 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 2.69 111.282 -178.665 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 CA--C 1.548 0.87 0 CA-C-O 119.316 -0.373 . . . . 6.81 111.871 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 4.53 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 6.7 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 2.56 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 1.76 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 2.57 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.25 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.06 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 3.12 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 2.89 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 4.31 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.32 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.41 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 553' ' ' VAL . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.13 113.495 -178.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 1.79 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 2.64 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 550' ' ' PRO . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 2.35 112.166 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 1.5 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 1.71 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.21 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 1.82 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 2.38 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 2.65 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.16 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 1.88 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 2.71 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 1.34 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 2.4 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.2 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.09 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.61 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 3.28 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 1.26 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 572' ' ' ILE . . . . . 0.442 HG12 HG13 ' A' ' 622' ' ' VAL . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 2.69 110.412 -164.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 11.97 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.32 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 4.09 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.37 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 6.34 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 3.32 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 1.89 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 4.25 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 2.58 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 1.22 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 3.74 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 1.88 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 1.85 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.39 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 3.54 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 2.34 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 2.87 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 4.62 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 3.85 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.8 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.02 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 2.79 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 2.48 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 1.85 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 1.72 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.36 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.18 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 5.48 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 2.9 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 6.73 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.44 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' A' ' 635' ' ' VAL . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 2.59 109.031 174.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 3.46 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 3.96 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 6.89 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 3.88 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 3.67 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 9.46 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 3.55 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 2.24 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.67 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 622' ' ' VAL . . . . . 0.442 HG13 HG12 ' A' ' 572' ' ' ILE . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 1.96 113.616 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 4.47 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 1.62 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.0 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 2.49 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 1.97 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 4.24 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 1.21 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 6.67 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 1.71 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 1.93 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.45 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.446 ' HB ' HD22 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 2.57 111.581 171.498 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.436 ' CG ' HD21 ' A' ' 612' ' ' LEU . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 3.16 111.668 170.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 1.56 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 2.57 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 2.54 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.77 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 1.8 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 2.8 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 4.62 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 6.99 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.82 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 3.25 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 4.79 111.881 174.182 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 112.864 0.69 . . . . 4.0 112.864 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 5.91 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 4.86 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.03 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 1.15 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 1.62 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.65 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 1.67 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 3.22 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 2.34 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 1.95 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 3.4 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.22 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.29 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.33 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 2.3 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 1.52 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 1.18 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 0.94 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.0 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 1.36 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.08 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 4.53 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 2.59 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 2.3 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 2.29 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 1.34 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 2.12 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.03 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 2.85 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 1.34 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 2.67 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 7.77 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.71 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 2.59 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 2.6 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 1.71 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.23 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 5.34 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.17 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 4.28 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 2.7 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.582 HD12 ' HB2' ' A' ' 605' ' ' SER . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 1.0 110.673 -162.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 3.78 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 4.71 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 0.87 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 0.78 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.37 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 2.82 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 2.37 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 2.94 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.37 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.12 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.557 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 4.38 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.17 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 2.48 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 0.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.46 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.582 ' HB2' HD12 ' A' ' 584' ' ' ILE . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.64 111.738 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 3.93 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 2.52 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 5.72 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.33 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.591 HD23 ' HB ' ' A' ' 635' ' ' VAL 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 3.24 114.224 -164.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 4.98 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.68 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.0 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.24 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 3.53 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 5.44 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 3.38 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 2.0 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 2.34 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 1.38 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 3.75 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 0.82 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 0.86 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG11 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 3.23 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 2.54 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 5.62 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 0.94 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.57 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 2.07 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 1.66 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.43 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.591 ' HB ' HD23 ' A' ' 612' ' ' LEU . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 2.41 111.607 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.414 ' CD1' HD22 ' A' ' 612' ' ' LEU . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 2.28 111.603 172.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.07 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 2.09 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 2.11 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.09 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 2.55 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 2.29 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.05 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 7.14 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 2.16 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 2.61 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.48 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 3.4 111.176 171.003 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.6 118.991 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.32 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.01 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 2.54 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.03 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 1.4 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 2.57 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.75 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 2.75 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 2.09 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 1.76 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 2.88 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.23 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.43 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 2.43 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 2.3 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 1.57 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 1.09 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 1.07 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 0.96 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 0.95 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 2.55 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 2.87 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 560' ' ' LEU . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.04 113.74 -151.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 2.28 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 2.63 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 0.9 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.422 ' CG ' HG22 ' A' ' 571' ' ' ILE . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 2.09 111.583 165.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.61 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.42 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 2.97 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.422 HG22 ' CG ' ' A' ' 565' ' ' PHE . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 1.64 114.658 -169.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 1.95 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 8.83 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 574' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 575' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 3.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.16 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.62 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 4.42 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 4.28 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.18 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 2.65 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 2.84 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 605' ' ' SER . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 0.71 110.92 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 2.81 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 1.04 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 0.92 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.41 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 3.13 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 1.93 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 2.66 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 4.57 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 5.55 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 2.47 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 2.33 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 0.97 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 1.7 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.43 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.462 ' HB2' HD12 ' A' ' 584' ' ' ILE . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.11 111.204 164.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 3.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 2.29 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 6.7 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 6.84 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 2.35 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 4.65 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 2.74 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 7.49 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.04 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 3.56 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 8.13 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.19 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 2.04 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 1.98 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 1.35 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.12 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 0.95 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 1.38 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 2.49 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 2.32 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.13 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 0.74 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.08 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 2.61 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 1.5 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 2.98 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 2.58 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 2.54 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 1.39 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 642' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 642' ' ' LEU . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 1.93 114.722 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 2.59 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.6 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 2.14 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 1.6 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 3.99 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 5.47 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 1.62 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 2.43 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.45 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 3.6 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 2.89 111.754 -178.518 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.73 116.366 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 4.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 4.43 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 2.4 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 1.75 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.25 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 3.65 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.27 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 3.55 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.0 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 2.53 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 2.02 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.21 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 1.25 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.06 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 1.8 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 1.92 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 1.44 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 0.81 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 0.71 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 0.75 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 0.85 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 1.63 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 2.81 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.436 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 1.98 113.401 -166.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 2.36 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 2.18 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' A' ' 629' ' ' ARG . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.01 111.985 175.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.417 ' CG ' HG22 ' A' ' 571' ' ' ILE . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 2.14 111.777 168.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.27 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 3.68 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.417 HG22 ' CG ' ' A' ' 565' ' ' PHE . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 1.17 112.869 -175.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 2.52 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 8.29 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 2.96 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 3.07 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 4.34 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 582' ' ' TYR . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 4.93 113.519 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.39 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 582' ' ' TYR . . . . . 0.417 ' CE2' ' HE3' ' A' ' 580' ' ' LYS . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 2.75 111.78 -174.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 2.82 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.497 HD12 ' HB2' ' A' ' 605' ' ' SER . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.0 111.77 -165.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 3.58 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 0.99 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 0.93 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 0.72 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.61 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 3.29 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 1.8 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 2.96 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 5.58 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 4.95 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.496 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 4.29 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 2.35 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 2.15 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 1.07 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 1.6 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.497 ' HB2' HD12 ' A' ' 584' ' ' ILE . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.17 111.325 167.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 8.64 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 607' ' ' PHE . . . . . 0.411 ' CZ ' HD11 ' A' ' 584' ' ' ILE . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 2.5 115.476 -173.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 610' ' ' ILE . . . . . 0.483 HG21 HG23 ' A' ' 614' ' ' THR . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 6.52 114.386 168.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.63 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.761 HD23 HG22 ' A' ' 635' ' ' VAL . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.08 114.578 -169.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 3.57 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 614' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 610' ' ' ILE . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 2.88 112.859 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 7.64 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 2.68 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.03 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 6.81 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 3.6 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 1.87 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 2.17 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 1.32 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.37 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.06 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.27 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 3.2 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 2.5 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 629' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 564' ' ' VAL . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.12 108.382 169.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 0.98 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 7.71 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 1.45 108.836 -171.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.761 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 2.58 111.984 -176.67 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 2.57 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 0.9 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 1.96 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 1.95 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.14 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.04 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 1.91 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 6.58 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 4.7 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 1.75 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 2.94 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.79 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 2.91 112.133 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.543 0.942 . . . . 4.03 113.543 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 5.81 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 4.56 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 2.7 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 539' ' ' VAL . . . . . 0.408 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.0 111.405 176.634 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.4 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 2.72 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.01 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 3.5 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' PHE . . . . . 0.408 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 2.27 112.061 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 1.8 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.08 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 1.28 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.8 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 3.39 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 2.16 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 2.85 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 1.15 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 0.86 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 0.77 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 0.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 2.22 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 2.99 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 2.43 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 1.83 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 2.35 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 0.96 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 2.35 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.48 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.08 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 2.64 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 1.13 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 572' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 622' ' ' VAL . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 2.54 111.8 -168.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 10.62 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.3 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 4.32 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 4.23 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 5.88 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 4.28 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 1.82 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 3.19 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 2.46 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.464 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 0.77 110.761 -165.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 3.77 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.83 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 588' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' A' ' 626' ' ' THR . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 0.86 109.033 176.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.433 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 0.75 110.818 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 2.56 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 2.34 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.07 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.33 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 6.62 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 2.77 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 1.95 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 1.13 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.54 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.06 114.129 177.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 6.75 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 2.31 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 7.59 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 6.26 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 2.24 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 5.18 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 4.56 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 6.98 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.1 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 6.87 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 5.75 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 4.65 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 1.94 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.19 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 622' ' ' VAL . . . . . 0.426 HG13 ' CG1' ' A' ' 572' ' ' ILE . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 0.91 115.625 -178.055 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 4.95 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 0.74 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 625' ' ' ASP . . . . . 0.433 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 626' ' ' THR . . . . . 0.406 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 0.86 110.186 -167.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 2.97 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.24 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.01 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 0.82 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.37 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 2.45 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 1.54 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 1.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.4 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 2.88 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.09 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 2.31 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 2.15 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.15 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 1.97 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 1.88 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.08 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 7.97 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.25 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 3.21 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.46 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.45 110.851 177.439 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 3.3 116.471 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 4.67 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 4.57 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 2.48 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 1.88 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.13 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.6 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 2.98 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 2.88 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 2.74 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 2.45 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.14 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 2.84 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 1.14 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.21 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 1.94 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 2.09 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 2.83 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.06 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 0.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 0.95 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 1.09 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 1.92 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 4.89 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 561' ' ' LYS . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 2.28 110.056 -173.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 561' ' ' LYS . . . . . 0.512 ' N ' HD23 ' A' ' 560' ' ' LEU . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.13 111.937 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 3.4 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 1.24 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' PHE . . . . . 0.413 ' CG ' HG22 ' A' ' 571' ' ' ILE . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 2.06 111.666 168.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.65 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.24 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 2.78 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 571' ' ' ILE . . . . . 0.413 HG22 ' CG ' ' A' ' 565' ' ' PHE . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 0.93 115.409 -160.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 1.48 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 7.41 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.56 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 2.86 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 2.58 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.74 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 4.72 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.17 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 1.95 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 2.49 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 2.75 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 1.48 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.1 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 2.75 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.23 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 0.99 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 0.72 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.25 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 591' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 599' ' ' MET . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 2.59 107.812 -141.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 1.78 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 2.6 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 5.37 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.49 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 4.66 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 599' ' ' MET . . . . . 0.508 ' O ' HG12 ' A' ' 591' ' ' VAL . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 2.84 110.33 162.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 2.43 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 1.19 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.51 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.8 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.64 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.01 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 2.19 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.14 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 6.31 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.795 HD23 HG22 ' A' ' 635' ' ' VAL . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 1.95 114.574 167.343 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.06 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.17 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 6.57 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.58 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.1 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 5.62 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 3.33 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.05 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 2.77 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.01 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 4.58 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 0.92 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.14 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 4.0 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 2.81 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 3.67 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 1.35 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.05 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.52 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 3.07 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.44 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 635' ' ' VAL . . . . . 0.795 HG22 HD23 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 2.8 109.584 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 2.58 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.448 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 2.64 109.447 168.33 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 0.93 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 2.29 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 2.25 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.36 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 2.31 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 1.66 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.16 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 6.97 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 1.79 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 2.34 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.63 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 3.61 111.945 -175.172 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 4.83 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 3.75 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 2.13 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 1.38 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.19 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.51 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.68 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 2.8 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 2.26 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 1.67 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 1.41 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.57 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 1.96 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 1.43 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 1.04 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 0.8 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 556' ' ' MET . . . . . 0.553 ' HG3' HG11 ' A' ' 641' ' ' VAL . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 1.56 114.512 171.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 0.86 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 2.02 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 2.55 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 633' ' ' LEU . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 2.21 112.311 -157.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 3.4 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 3.05 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.438 HG11 ' CE1' ' A' ' 627' ' ' TYR . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 1.16 111.776 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 1.92 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.53 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 4.02 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 1.16 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 1.73 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 7.15 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.59 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 2.94 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.21 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.05 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 4.93 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 6.63 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 2.31 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 5.46 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 2.68 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.583 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 1.2 111.458 -170.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 2.54 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.14 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 1.02 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 0.86 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.08 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.02 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 2.46 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.23 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 4.87 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 4.99 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 3.34 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.03 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 2.26 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 1.26 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 2.52 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.583 ' HB2' HD12 ' A' ' 584' ' ' ILE . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 3.81 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 2.21 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 8.44 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 6.14 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 2.21 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 4.44 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 4.42 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.12 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.48 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 4.45 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 7.05 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 3.99 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 1.9 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 2.76 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.11 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 5.12 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.17 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 1.29 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.438 ' CE1' HG11 ' A' ' 564' ' ' VAL . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 2.66 108.577 170.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 2.75 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.26 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 1.33 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.55 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 1.79 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.492 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 1.36 111.062 -177.55 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.28 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 1.9 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 637' ' ' ASN . . . . . 0.686 ' O ' HG12 ' A' ' 641' ' ' VAL . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.18 112.775 174.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 2.78 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 641' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 637' ' ' ASN . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 1.23 112.633 -172.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 2.24 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 2.07 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.43 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.26 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 2.26 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 6.49 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 6.69 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 1.65 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 2.61 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.7 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 3.05 111.02 175.027 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.084 0.772 . . . . 3.39 113.084 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 4.4 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 3.96 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 3.18 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 1.21 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 1.47 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.12 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.09 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.26 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 2.67 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 2.16 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 1.8 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 1.1 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.04 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 1.84 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 1.86 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 1.37 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 0.93 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.02 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 1.42 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 1.32 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.51 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 5.04 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 2.63 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 1.99 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 2.55 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 0.94 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 2.04 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.32 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 2.66 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 1.21 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.04 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 8.59 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.23 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 2.18 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.48 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 3.99 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 3.63 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 1.99 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 2.6 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 3.6 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.52 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.19 110.287 -161.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 2.66 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 0.92 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 588' ' ' VAL . . . . . 0.437 ' H ' ' CG2' ' A' ' 626' ' ' THR . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 0.99 108.117 171.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 0.71 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.1 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 2.9 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 1.63 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.51 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 6.39 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 3.8 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.69 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 597' ' ' LYS . . . . . 0.421 ' H ' ' CD ' ' A' ' 597' ' ' LYS . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 6.34 116.306 -168.685 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 1.73 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 2.36 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 1.66 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.54 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.42 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 584' ' ' ILE . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.18 111.852 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 4.06 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 2.76 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 2.66 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 609' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 610' ' ' ILE . . . . . 0.44 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.18 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 7.38 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 3.75 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 3.74 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.12 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 10.03 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.26 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 3.84 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 7.39 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 3.43 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 1.97 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 1.85 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 0.95 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 3.97 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 1.04 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 626' ' ' THR . . . . . 0.437 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 1.48 109.306 -175.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 3.66 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 2.37 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 3.25 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 0.8 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.03 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 1.71 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 1.43 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.5 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 2.66 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 2.53 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.17 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 1.12 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 1.86 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 2.41 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 1.87 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 2.28 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 2.06 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 4.88 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 5.07 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.42 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 2.79 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 4.65 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.63 111.745 174.076 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 113.866 1.061 . . . . 3.63 113.866 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 4.46 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.0 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 2.43 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.12 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 1.57 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 2.77 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.59 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 3.49 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 2.28 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 1.7 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 2.99 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 1.35 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.22 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.32 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 2.19 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 1.57 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.08 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 0.77 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 0.92 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 1.06 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.02 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 559' ' ' LYS . . . . . 0.423 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 2.43 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.421 HD13 ' HG ' ' A' ' 633' ' ' LEU . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 2.3 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 561' ' ' LYS . . . . . 0.412 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.24 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 2.51 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 564' ' ' VAL . . . . . 0.529 HG11 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 0.92 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 2.66 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 2.76 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.17 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 1.89 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 7.47 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 2.97 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 2.47 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 1.75 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 579' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 579' ' ' LYS . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 4.4 113.056 -167.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.28 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 2.23 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 3.03 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 2.48 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 584' ' ' ILE . . . . . 0.449 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.29 109.627 -172.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 3.2 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.27 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 1.34 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.09 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.39 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.03 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 2.37 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.04 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 594' ' ' LYS . . . . . 0.532 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 5.93 115.87 -161.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.74 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.14 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.28 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 2.38 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 1.56 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 1.76 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.65 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 605' ' ' SER . . . . . 0.449 ' HB2' HD12 ' A' ' 584' ' ' ILE . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.32 110.583 160.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 3.82 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 2.71 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 7.47 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 612' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 638' ' ' PHE . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 3.05 112.898 -164.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 6.67 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 4.32 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 8.2 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.09 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 6.53 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 2.98 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 1.47 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 1.81 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 0.99 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 3.48 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.14 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.34 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 627' ' ' TYR . . . . . 0.529 ' CE1' HG11 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 3.25 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 2.61 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 4.62 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 1.16 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.32 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 2.34 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.421 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 2.56 112.02 -178.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.64 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 1.77 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 638' ' ' PHE . . . . . 0.41 ' CE1' HD11 ' A' ' 612' ' ' LEU . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 2.93 111.438 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 1.05 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 2.58 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 2.25 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.65 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 1.66 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 1.97 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 4.3 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 5.44 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.16 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 2.76 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.49 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 3.42 111.706 173.394 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.344 1.238 . . . . 8.86 114.344 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m -73.42 38.6 0.09 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.647 2.379 . . . . 3.82 116.017 -170.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 6.48 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.32 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 3.78 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 1.55 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 2.5 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.49 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 3.49 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.16 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 2.39 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 3.26 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 3.97 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 1.87 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.25 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 2.8 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 1.49 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 1.17 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 1.1 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 1.14 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 1.31 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 1.85 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 2.61 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 2.71 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 1.83 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 2.85 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.443 HG11 ' CE1' ' A' ' 627' ' ' TYR . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 0.99 111.793 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 2.31 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.47 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 3.18 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 1.24 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 2.51 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 9.79 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 3.28 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 3.65 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 1.92 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 4.47 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 4.48 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.24 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 2.37 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 2.91 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.419 HD11 ' CE2' ' A' ' 607' ' ' PHE . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 1.01 111.885 -159.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 2.82 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.88 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 1.11 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 1.07 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.4 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' VAL . . . . . 0.443 HG13 ' HB2' ' A' ' 599' ' ' MET . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 2.5 107.743 -140.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 2.49 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.47 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 594' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.35 114.664 -169.611 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.78 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 5.45 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 599' ' ' MET . . . . . 0.443 ' HB2' HG13 ' A' ' 591' ' ' VAL . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 2.65 110.739 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 2.84 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 1.57 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 1.83 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.404 ' HB2' HD12 ' A' ' 584' ' ' ILE . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.46 113.502 175.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 6.15 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 607' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 584' ' ' ILE . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 2.3 113.835 175.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 7.84 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 5.73 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.764 HD23 HG22 ' A' ' 635' ' ' VAL . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.43 113.349 174.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 4.82 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 4.81 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 6.89 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.32 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 3.62 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 5.63 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 3.44 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 2.17 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.11 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 1.51 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 4.87 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 1.16 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.01 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.443 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 3.84 106.921 164.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 1.96 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 3.58 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 1.04 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.24 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 2.07 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 2.33 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.03 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.764 HG22 HD23 ' A' ' 612' ' ' LEU . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 2.59 110.89 -174.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.437 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 3.01 109.322 161.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 1.49 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 2.61 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 2.51 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.49 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 2.84 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 2.51 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 3.88 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 5.3 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 2.75 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 3.63 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 4.88 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -62.13 -26.05 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.47 112.493 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -52.68 -12.36 0.29 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 125.652 1.581 . . . . 4.04 114.817 166.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 13.5 tt -139.08 -27.67 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.639 1.348 . . . . 7.43 114.639 161.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.12 -18.5 65.33 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.404 -1.435 . . . . 5.15 114.772 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -71.61 -11.81 61.04 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 116.961 2.208 . . . . 7.08 116.961 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.28 -50.57 64.59 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.206 1.187 . . . . 8.68 114.206 -162.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -99.69 10.9 40.53 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.455 1.28 . . . . 10.7 114.455 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -84.15 5.32 26.7 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.573 -1.33 . . . . 14.35 113.593 -174.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 1.7 mp -33.9 88.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 130.309 3.444 . . . . 16.94 117.205 -160.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 64.59 19.13 64.52 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 126.55 2.024 . . . . 21.2 114.881 165.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -73.81 150.22 41.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.547 1.174 . . . . 22.1 112.357 -172.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -103.15 151.68 22.31 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.882 1.273 . . . . 27.38 110.647 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.0 -51.08 69.49 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.532 0.733 . . . . 29.71 111.769 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 44.1 p -125.46 -72.08 0.68 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.901 1.68 . . . . 31.83 110.912 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 24.1 pt -151.67 159.59 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 127.578 2.351 . . . . 37.34 110.625 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 35.3 tp -91.86 57.7 3.24 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.641 1.577 . . . . 36.79 110.382 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 47.8 tp -132.86 133.89 43.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.217 1.407 . . . . 41.63 111.401 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 . . . . . 0 C--O 1.256 1.41 0 C-N-CA 129.642 3.177 . . . . 45.17 116.166 -177.673 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 CA--C 1.554 1.115 0 N-CA-C 109.237 -0.653 . . . . 8.21 109.237 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.62 42.66 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.804 1.642 . . . . 4.08 114.661 -169.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 3.79 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.25 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 2.42 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.11 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 1.43 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 2.79 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 1.87 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 2.41 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 2.13 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 1.6 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.76 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 0.98 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.06 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 1.8 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 1.83 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 1.34 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 0.97 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 0.81 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 0.84 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 0.94 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 1.88 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 2.67 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 2.4 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 1.83 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 2.35 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.505 HG11 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 0.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 1.85 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.89 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 2.3 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.419 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 0.87 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 1.46 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 7.42 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.02 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 3.2 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.09 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 4.24 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 3.42 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 1.96 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 2.4 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 2.78 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 605' ' ' SER . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 0.81 110.336 -166.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 2.99 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.75 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 0.76 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 0.66 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.06 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 591' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 599' ' ' MET . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 2.57 107.628 -142.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 1.54 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.18 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.0 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.58 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.498 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.498 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 4.39 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 599' ' ' MET . . . . . 0.465 ' O ' HG12 ' A' ' 591' ' ' VAL . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 1.68 111.825 -169.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 1.91 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 0.97 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 1.65 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.09 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.471 ' HB2' HD12 ' A' ' 584' ' ' ILE . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.91 111.862 172.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 3.55 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 2.3 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.0 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 7.26 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.433 HD11 ' CD1' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 3.24 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 4.43 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 3.55 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 6.38 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.82 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.1 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 10.33 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.01 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.45 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 3.33 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 0.89 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.2 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 0.77 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 0.97 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.505 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 3.17 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 2.47 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 4.4 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 0.86 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 7.52 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.22 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 1.5 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.16 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 1.86 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.433 ' CD1' HD11 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 2.54 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 0.92 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 2.97 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 2.19 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.66 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 1.89 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 1.63 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 5.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 6.66 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.06 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 2.76 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p -102.55 -37.43 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.19 111.755 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -51.86 -41.78 62.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.207 1.003 . . . . 5.41 113.17 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -64.98 -10.94 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 114.931 1.456 . . . . 7.43 114.931 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -117.9 -36.45 3.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.587 1.555 . . . . 7.49 112.092 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -66.07 -18.2 65.19 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.36 1.464 . . . . 7.99 113.592 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 35.8 tp -47.38 -33.7 6.22 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.54 2.336 . . . . 7.99 115.386 171.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -50.01 142.65 9.01 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.368 1.618 . . . . 11.33 115.368 -171.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -62.58 -3.15 1.32 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.985 2.514 . . . . 15.65 117.197 -163.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 10.8 mm -71.8 99.76 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 123.605 1.669 . . . . 17.77 113.447 -157.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 59.83 23.23 58.69 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.117 2.294 . . . . 21.65 113.037 -169.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -140.54 147.15 39.06 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.301 1.44 . . . . 19.97 113.853 -161.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -67.66 155.75 38.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.848 1.259 . . . . 24.95 110.517 172.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -129.19 173.12 10.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.76 1.624 . . . . 21.78 112.704 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.8 m -146.88 -173.54 4.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.718 1.607 . . . . 22.63 112.533 -175.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 20.2 pt -66.15 150.93 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.701 2.001 . . . . 24.88 112.848 172.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -105.92 166.06 10.75 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.636 1.347 . . . . 22.79 114.636 -172.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 51.2 tp -84.02 145.92 28.24 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.545 1.313 . . . . 25.42 114.545 -175.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 52.6 t60 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 131.022 3.729 . . . . 29.77 115.733 169.178 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 110.468 -0.197 . . . . 7.73 110.468 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m -65.59 145.61 55.86 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 170.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 7.6 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 7.26 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 2.23 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 1.73 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.01 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.45 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.45 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.07 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 2.41 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 2.37 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 1.94 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 2.75 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.06 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' A' ' 553' ' ' VAL . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.35 113.962 -177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 1.88 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 2.59 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 550' ' ' PRO . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 2.59 112.498 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 0.95 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 0.74 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.15 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 0.99 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 1.87 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 2.54 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.51 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 2.17 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 561' ' ' LYS . . . . . 0.51 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.01 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 2.32 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 0.79 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 2.43 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.19 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 3.44 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.427 HD12 ' CZ ' ' A' ' 607' ' ' PHE . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 1.57 112.737 -173.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 2.8 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 9.24 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 4.69 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.13 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 2.55 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 2.49 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 1.88 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 4.83 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 6.12 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.37 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 2.71 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 3.45 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 1.03 109.639 -155.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 2.27 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 1.38 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 0.95 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 2.6 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 2.2 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 2.8 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.23 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 4.76 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 4.78 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 2.27 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 2.19 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 1.51 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.47 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.62 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.36 111.963 170.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 3.93 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 607' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 571' ' ' ILE . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 3.13 110.36 176.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.77 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 5.33 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 5.47 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 3.21 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 3.83 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.34 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.05 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.1 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 5.37 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 7.39 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.07 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 2.35 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 1.97 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 0.88 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 5.16 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 0.82 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.11 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 3.0 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 2.21 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 2.92 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 1.13 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.01 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 2.69 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 1.48 106.236 174.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 2.55 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 2.63 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 1.57 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 2.2 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 2.7 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.46 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 1.69 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 2.04 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 6.42 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 5.46 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 1.46 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 2.07 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.54 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p -79.16 -32.79 15.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.47 111.201 -174.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.55 -22.32 32.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.634 1.174 . . . . 2.89 113.941 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.3 tt -98.05 -46.15 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.334 1.054 . . . . 4.48 112.107 167.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.16 -39.78 93.8 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.418 1.008 . . . . 4.41 113.309 -174.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -65.75 -28.15 68.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.468 1.907 . . . . 5.17 114.03 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.93 -25.09 13.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.239 1.416 . . . . 4.63 111.687 -172.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.68 162.28 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.454 2.702 . . . . 7.31 114.201 -173.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -75.52 -58.18 3.44 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.982 -1.074 . . . . 14.63 111.645 -170.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 17.2 mm 60.56 137.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 126.853 2.061 . . . . 13.13 114.6 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -66.35 -35.98 91.0 Favored Glycine 0 CA--C 1.532 1.133 0 O-C-N 120.366 -1.459 . . . . 17.29 113.355 -173.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -79.94 9.04 5.82 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.894 1.813 . . . . 17.2 115.894 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -59.97 148.04 36.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.973 1.309 . . . . 20.33 112.544 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -72.05 154.2 41.27 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.953 0.901 . . . . 23.16 111.615 169.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 23.8 m -70.9 178.44 3.15 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.848 -1.158 . . . . 25.14 112.71 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 21.4 pt -56.59 162.81 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.892 1.441 . . . . 28.7 114.892 -169.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 46.4 tp -107.18 142.94 36.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.635 1.974 . . . . 28.0 112.089 -174.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.515 HD12 ' H ' ' A' ' 672' ' ' HIS . 51.3 tp -72.86 155.28 40.07 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.785 1.032 . . . . 32.82 113.785 -175.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.515 ' H ' HD12 ' A' ' 671' ' ' LEU . 68.4 t60 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 128.981 2.913 . . . . 35.95 116.352 -170.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 29.4 m120 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 115.027 1.491 . . . . 6.61 115.027 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t -51.4 -30.4 18.99 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.427 1.891 . . . . 3.62 114.914 -172.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 3.9 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 4.58 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 3.55 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 1.9 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.56 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 4.59 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 2.97 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.27 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 2.68 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 2.86 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 2.46 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 2.93 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 1.69 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.76 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.28 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 2.08 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 1.91 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 1.14 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 0.81 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.12 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 1.31 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.0 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.08 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.452 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 2.18 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 1.89 112.611 -173.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 2.84 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.535 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 1.04 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 2.18 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.1 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.24 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 2.36 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.34 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 1.83 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 8.17 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.03 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.24 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 3.22 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.26 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.23 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 3.43 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 2.55 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 2.84 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 3.31 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 0.88 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 2.56 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 0.98 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 0.75 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 0.72 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 2.79 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 2.55 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.34 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 594' ' ' LYS . . . . . 0.415 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.12 110.287 172.265 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 6.62 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 4.99 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 2.8 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 1.71 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 1.24 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 1.81 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.3 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 3.86 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 2.24 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.21 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 6.22 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.492 HD23 ' HB ' ' A' ' 635' ' ' VAL . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 3.06 115.96 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.06 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 2.86 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 8.04 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 2.88 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 3.9 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 6.44 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 4.09 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 2.17 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.18 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 1.05 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 3.71 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 0.81 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 0.86 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.535 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 3.11 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 2.27 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 2.81 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 0.87 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 6.6 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.14 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 1.27 110.438 -170.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.492 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 1.87 111.28 -172.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' A' ' 612' ' ' LEU . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 2.49 111.468 175.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 0.97 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 2.34 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 2.23 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 1.99 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 648' ' ' MET . . . . . 0.526 ' HA ' ' HB3' ' A' ' 651' ' ' ALA . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 2.69 110.787 -177.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 4.84 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 5.91 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 651' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 648' ' ' MET . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 2.09 112.961 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 2.41 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.02 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -104.8 -29.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.04 112.622 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.53 -36.35 64.16 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.67 1.188 . . . . 3.57 112.276 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.8 pp -66.3 -8.47 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 114.694 1.368 . . . . 6.24 114.694 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -103.7 -38.58 7.02 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.88 1.272 . . . . 7.22 112.459 164.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -80.44 -13.4 59.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.476 1.511 . . . . 8.4 114.572 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.9 tt -101.47 -21.73 14.7 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.494 1.518 . . . . 7.11 113.884 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -139.06 175.86 9.19 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 125.648 1.579 . . . . 9.15 110.543 -175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -92.12 -9.39 42.71 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 118.22 2.674 . . . . 12.58 118.22 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 663' ' ' ILE . . . . . 0.647 HD12 ' H ' ' A' ' 663' ' ' ILE . 0.8 OUTLIER -68.4 -36.63 75.69 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 116.874 2.175 . . . . 9.93 116.874 -157.403 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 91.44 18.45 45.41 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.059 1.314 . . . . 14.03 116.048 -175.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -117.27 137.47 52.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.963 2.105 . . . . 15.14 110.481 -176.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -135.45 155.85 49.87 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.45 1.1 . . . . 22.37 113.465 -171.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -107.97 174.48 5.86 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.633 1.973 . . . . 22.14 112.765 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.6 p -134.26 -145.72 0.24 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.798 1.239 . . . . 25.42 112.165 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.3 pt -84.09 166.84 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.093 1.357 . . . . 31.2 112.893 -175.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 97.0 mt -95.13 149.06 21.7 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.089 0.956 . . . . 31.6 109.234 156.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.9 tp -144.06 168.45 19.98 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.763 1.268 . . . . 35.08 114.192 -167.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.264 0 C-N-CA 129.766 3.226 . . . . 41.85 112.414 169.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 59.9 t30 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 120.784 0.326 . . . . 6.75 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m 70.01 12.88 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 3.78 116.899 171.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 5.63 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 5.92 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 2.16 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.17 111.097 172.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 1.56 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 2.95 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.64 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.72 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 3.39 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 2.41 112.337 -178.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 1.67 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 2.85 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.477 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 1.1 114.466 -168.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.43 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 2.48 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 2.3 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.477 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 1.57 112.134 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 1.54 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 1.13 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 0.76 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 1.16 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 2.87 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 2.74 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 2.67 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 2.86 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 2.13 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 0.84 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 2.14 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.9 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 2.49 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.07 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 1.65 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 7.44 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 2.7 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.05 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.65 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 7.35 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 3.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.25 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 3.04 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 2.81 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 0.78 111.463 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 2.6 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.23 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 0.92 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 0.7 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.13 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 2.52 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 2.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.33 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 4.5 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 3.88 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 3.59 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.1 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 1.87 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 2.19 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 0.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 1.66 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.12 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.85 112.392 174.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 3.63 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 2.27 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 5.8 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 5.09 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.785 HD23 HG22 ' A' ' 635' ' ' VAL . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 2.17 115.331 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 4.3 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 3.49 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 7.95 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 1.91 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 3.71 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 6.38 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 3.14 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 1.64 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.58 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 0.92 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 4.69 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 0.72 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 0.86 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 3.21 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.09 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 3.96 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 1.04 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.25 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 1.98 113.364 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 1.38 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.785 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 2.62 110.902 176.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 2.94 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.2 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.06 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 2.42 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.67 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 1.79 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 1.88 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 4.79 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 5.28 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 1.52 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 2.49 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.45 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 2.55 113.068 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.32 -23.89 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.479 1.289 . . . . 2.9 114.479 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -70.64 -24.38 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.603 1.161 . . . . 4.43 113.287 172.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -95.09 -48.45 5.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.958 1.303 . . . . 5.86 111.647 177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 92.1 mtt-85 -64.82 -10.64 29.62 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.28 1.832 . . . . 6.85 114.213 174.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 67.6 tp -38.75 -46.35 1.24 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.57 1.948 . . . . 5.62 112.404 161.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -93.45 132.15 37.98 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.452 1.101 . . . . 7.85 112.355 177.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 3.2 ppt_? -79.82 4.49 16.36 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.223 2.209 . . . . 14.77 116.375 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.3 1.2 mp 49.26 153.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 130.662 3.585 . . . . 13.46 116.785 -170.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -69.04 152.98 52.68 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 120.818 -1.177 . . . . 16.42 110.515 162.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.43 168.74 9.39 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.074 0.949 . . . . 19.93 113.164 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -73.75 44.91 0.18 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.799 2.04 . . . . 28.5 112.358 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -63.2 145.75 54.84 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.244 1.418 . . . . 27.14 113.236 -163.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 72.1 p -158.81 -176.9 6.14 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.292 1.437 . . . . 30.88 112.651 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.7 pt -101.92 154.4 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.0 1.32 . . . . 37.16 113.494 -162.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 72.7 mt -127.3 168.48 14.72 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.906 1.682 . . . . 38.21 112.467 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.435 HD12 ' H ' ' A' ' 672' ' ' HIS . 60.3 tp -66.94 153.97 42.24 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.685 1.994 . . . . 44.67 113.617 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.435 ' H ' HD12 ' A' ' 671' ' ' LEU . 20.4 t-80 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 129.534 3.134 . . . . 47.66 114.162 178.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 50.9 t30 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.879 0.371 . . . . 7.05 111.635 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m -99.06 141.23 32.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.125 0.97 . . . . 7.99 112.396 -172.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 6.1 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.17 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 2.89 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.473 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 1.16 111.43 177.34 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 1.59 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.61 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 1.91 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 2.45 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' PHE . . . . . 0.473 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 2.25 113.448 175.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 1.64 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 2.73 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 1.04 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.08 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.03 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 2.15 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 1.42 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 0.9 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 0.73 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.1 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 0.96 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 1.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 2.8 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 2.63 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 3.25 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 2.95 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.56 HG11 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 1.24 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.43 ' CD2' HG22 ' A' ' 571' ' ' ILE . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 2.51 111.316 167.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 2.31 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.43 HG22 ' CD2' ' A' ' 565' ' ' PHE . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 1.34 113.119 -169.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 1.82 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 7.3 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 3.91 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 2.83 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 2.33 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.75 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 4.42 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.02 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 1.74 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 2.92 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 2.52 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.527 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 0.84 110.699 -164.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.03 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.06 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 1.27 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 0.82 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 599' ' ' MET . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 2.62 108.582 -138.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 2.68 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.05 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 5.87 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.38 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 3.86 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 599' ' ' MET . . . . . 0.451 ' O ' HG12 ' A' ' 591' ' ' VAL . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 1.87 112.14 -169.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 2.33 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 0.94 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 3.46 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.527 ' HB2' HD12 ' A' ' 584' ' ' ILE . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 0.94 112.688 175.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 3.41 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 2.23 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 8.3 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 5.13 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 635' ' ' VAL . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.25 114.005 -163.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 5.4 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 3.86 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.08 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.03 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 3.46 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 6.43 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 4.7 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 1.87 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.22 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 1.13 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 4.2 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.16 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 1.4 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.56 ' CE1' HG11 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 4.08 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 2.51 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 4.49 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.27 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.15 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 2.76 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 1.38 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 2.63 111.007 173.521 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.57 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 2.76 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 1.06 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 2.09 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 2.35 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.28 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 1.81 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 1.53 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 4.84 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 5.6 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 1.75 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 2.48 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 3.35 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p -70.0 -36.74 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 2.74 111.202 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.41 -18.34 38.29 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.354 1.242 . . . . 3.21 114.354 177.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -108.76 -28.39 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.678 1.191 . . . . 5.27 113.701 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.47 -25.81 61.57 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 119.869 -1.77 . . . . 4.23 113.055 171.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -91.71 -16.35 27.07 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.589 1.955 . . . . 5.84 113.029 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 9.0 tt -74.06 -23.82 59.43 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.576 1.55 . . . . 5.03 112.651 165.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.73 156.59 34.97 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.245 1.202 . . . . 7.13 114.245 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.04 -14.32 62.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.299 2.239 . . . . 11.67 114.654 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 16.8 mm 54.69 -105.5 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.161 1.785 . . . . 11.09 111.837 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -91.97 -4.51 67.0 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.998 1.761 . . . . 14.51 114.717 -179.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -80.75 111.09 16.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 118.042 0.921 . . . . 14.44 109.457 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -127.67 -18.67 4.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.735 2.014 . . . . 21.21 112.731 -172.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -71.8 -35.16 69.89 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.13 0.789 . . . . 23.26 113.13 -170.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 19.4 m -77.77 179.34 6.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.899 1.279 . . . . 22.05 112.79 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 23.4 pt -69.03 158.8 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 125.945 1.698 . . . . 26.23 113.732 -172.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.13 177.41 8.83 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.639 1.576 . . . . 25.51 113.791 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 128.04 34.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.631 1.172 . . . . 26.73 110.495 175.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.327 0 C-N-CA 127.911 2.484 . . . . 32.8 113.625 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 107.797 -1.186 . . . . 6.78 107.797 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t -58.72 -16.06 14.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 4.39 114.64 -175.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.34 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.03 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 2.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 1.21 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 1.53 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 2.73 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 2.81 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.12 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.06 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 2.31 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 1.79 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 2.96 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 1.05 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.19 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 3.04 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 2.35 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 1.5 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 1.09 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 0.9 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 1.09 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 1.14 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 3.08 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.09 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 2.42 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 2.72 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 2.59 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 0.98 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.484 ' CG ' HG22 ' A' ' 571' ' ' ILE . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 2.18 111.139 169.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 3.25 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.39 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 2.73 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.484 HG22 ' CG ' ' A' ' 565' ' ' PHE . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 0.93 114.683 -163.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 1.5 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 7.21 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.75 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 4.25 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 2.95 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.08 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 4.61 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 3.49 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 1.74 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 3.16 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 2.51 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.13 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 4.35 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.01 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 0.88 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 0.94 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.37 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 591' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 599' ' ' MET . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 2.96 108.616 -137.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 2.17 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.07 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 3.96 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.43 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.561 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.561 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 4.17 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 599' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 591' ' ' VAL . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.36 113.075 -167.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.11 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 1.88 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.52 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.05 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 3.62 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 2.01 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.35 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 5.7 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.04 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.439 HD21 ' CG ' ' A' ' 638' ' ' PHE . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 2.51 113.103 -162.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 3.9 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 3.79 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 12.23 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 3.5 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 3.46 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.09 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 5.38 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 2.23 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.03 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 1.41 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 4.68 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 0.98 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 1.3 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 4.07 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 2.79 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 4.36 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 1.08 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 6.8 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 1.62 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 1.53 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.421 ' HB ' HD22 ' A' ' 612' ' ' LEU . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 1.87 112.092 174.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.439 ' CG ' HD21 ' A' ' 612' ' ' LEU . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 2.66 111.98 163.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 1.2 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 2.74 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 2.19 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.64 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 2.81 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 1.79 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 5.71 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 5.91 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.01 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -101.48 -32.95 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.12 111.644 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -45.24 -41.56 8.58 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.993 1.717 . . . . 5.85 114.299 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -12.34 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 114.266 1.21 . . . . 8.65 114.266 -175.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -114.13 -29.36 7.0 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.957 1.703 . . . . 7.03 112.931 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -60.93 -24.15 65.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.802 2.041 . . . . 6.14 115.932 -166.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 5.8 tt -51.95 -57.23 10.05 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 8.56 113.607 -170.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -88.63 2.08 53.84 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.791 1.237 . . . . 10.95 113.712 -173.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -80.41 -25.71 38.87 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.659 1.355 . . . . 18.3 114.659 -169.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 12.5 mm 48.87 138.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 129.972 3.309 . . . . 16.87 118.199 149.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -73.13 21.59 1.03 Allowed Glycine 0 CA--C 1.538 1.521 0 O-C-N 119.914 -1.742 . . . . 21.0 115.921 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.32 133.4 44.97 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.663 1.585 . . . . 22.48 112.522 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -136.06 164.86 27.03 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.962 1.705 . . . . 30.25 111.265 -177.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -64.62 -18.73 65.19 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.656 0.782 . . . . 33.18 112.088 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 51.9 p -87.94 -42.68 12.31 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.274 2.23 . . . . 31.85 115.295 170.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 46.1 pt -144.8 153.86 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 114.962 1.467 . . . . 31.89 114.962 -161.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.76 165.92 25.24 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.723 2.809 . . . . 29.88 109.283 171.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.9 tp -147.23 81.08 1.53 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.633 1.346 . . . . 31.03 114.633 175.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 . . . . . 0 C--O 1.257 1.489 0 C-N-CA 127.699 2.4 . . . . 34.61 115.578 153.811 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 115.298 1.592 . . . . 8.12 115.298 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p -48.64 -34.09 11.14 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.07 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 537' ' ' LYS 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 6.79 113.887 167.295 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 2.51 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.459 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 1.29 110.703 173.754 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 1.82 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.38 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 1.95 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 2.87 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' PHE . . . . . 0.459 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 2.69 112.999 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 1.52 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 2.69 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.453 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 1.32 114.057 -170.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.25 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 1.87 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 1.86 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.453 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 1.73 111.691 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 1.74 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 1.17 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.12 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 560' ' ' LEU . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 1.47 114.06 -165.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 2.19 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 3.21 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 557' ' ' LEU . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 2.76 112.064 -167.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.03 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 2.74 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 0.95 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 2.15 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 2.59 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 1.14 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 1.57 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 7.83 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 2.69 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 3.02 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 1.84 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 3.97 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 4.94 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 2.58 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 2.99 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 2.67 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 605' ' ' SER . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 0.92 111.284 -161.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.6 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 3.99 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 0.95 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 0.99 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 0.98 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.54 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 3.46 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 1.97 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 3.37 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 594' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 6.39 117.7 -162.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 4.87 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.48 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 3.62 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 2.39 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 2.61 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 0.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 1.74 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.457 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.01 111.429 170.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 5.78 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 2.52 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 5.73 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 5.4 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.776 HD23 HG22 ' A' ' 635' ' ' VAL . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.01 112.946 -167.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 613' ' ' LEU . . . . . 0.665 ' H ' HD13 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 3.37 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 2.98 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 7.03 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.36 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 5.02 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 5.64 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.13 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 1.53 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 1.93 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 1.09 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 3.72 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 0.99 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 1.12 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 3.41 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 2.76 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 2.92 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.07 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 7.47 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.4 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 1.35 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 2.47 112.19 -174.495 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 2.4 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.15 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.01 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 2.3 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.48 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 1.74 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 1.72 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 4.56 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 5.38 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 1.72 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 2.16 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.53 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p -99.22 -37.13 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 2.56 112.137 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -53.98 -36.55 63.03 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.447 0.906 . . . . 2.86 113.447 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -59.81 -21.16 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 114.258 1.207 . . . . 5.05 114.258 177.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -101.98 -32.59 10.1 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.603 1.561 . . . . 5.7 112.332 171.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.0 tpt85 -61.74 -34.02 75.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.86 1.264 . . . . 5.68 113.747 -176.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.68 -13.42 59.91 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.61 1.564 . . . . 5.98 112.425 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 t70 46.11 -129.23 1.32 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.932 2.093 . . . . 7.85 113.725 172.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -91.31 -1.81 57.55 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.225 1.565 . . . . 12.16 115.225 169.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 663' ' ' ILE . . . . . 0.404 ' H ' HG13 ' A' ' 663' ' ' ILE . 2.9 pp -106.84 10.56 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.672 1.989 . . . . 14.63 115.679 -167.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -60.39 -32.4 77.22 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 118.459 -1.19 . . . . 18.28 114.972 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 47.65 78.84 0.07 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 127.42 2.288 . . . . 20.26 114.241 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -53.87 137.95 37.43 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.637 1.575 . . . . 26.31 113.236 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -105.21 133.5 49.88 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.411 1.484 . . . . 27.39 111.167 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.1 m -134.79 -173.92 3.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.776 1.23 . . . . 29.79 112.202 -175.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.8 pt -60.69 159.59 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.837 1.655 . . . . 34.27 115.094 -172.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.37 43.77 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.725 2.01 . . . . 36.13 110.882 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.463 HD12 ' H ' ' A' ' 672' ' ' HIS . 28.7 tp -149.59 157.96 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 122.684 1.231 . . . . 39.75 112.916 -170.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.463 ' H ' HD12 ' A' ' 671' ' ' LEU . 56.1 t-80 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.62 2.768 . . . . 42.94 114.293 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.463 -0.569 . . . . 7.85 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -104.24 -30.71 9.99 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.596 1.158 . . . . 3.33 112.583 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 5.64 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 3.71 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 2.44 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 1.84 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.12 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.52 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.42 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.46 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 2.81 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 2.62 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 1.82 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 4.68 113.705 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 1.27 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.28 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 2.26 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 2.34 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 1.91 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 1.32 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 0.77 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' MET . . . . . 0.549 ' HB3' HG11 ' A' ' 641' ' ' VAL . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 1.77 115.459 174.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 1.57 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 1.88 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 2.62 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.408 HD13 ' HG ' ' A' ' 633' ' ' LEU . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 2.58 114.135 -159.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 1.97 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 2.82 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 2.67 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 0.83 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 2.15 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.21 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 2.78 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.412 HD11 HG13 ' A' ' 622' ' ' VAL . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 1.42 115.626 -167.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.56 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 10.42 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.62 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.71 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 3.77 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 2.49 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 1.94 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.1 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 3.43 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 1.83 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 2.38 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 2.52 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 605' ' ' SER . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 0.74 111.575 -164.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.8 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 2.43 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 1.1 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 1.01 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.68 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 3.05 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 1.61 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 2.49 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 4.5 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 3.86 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.403 ' H ' ' HE2' ' A' ' 597' ' ' LYS . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.39 112.125 177.047 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 2.12 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.06 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 1.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.62 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.496 ' HB2' HD12 ' A' ' 584' ' ' ILE . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.07 111.551 167.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 3.43 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 2.36 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 7.63 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 6.53 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.482 HD22 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 2.55 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 3.51 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.2 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 10.6 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 2.45 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 4.26 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 4.9 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 3.24 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 1.8 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.07 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 622' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 571' ' ' ILE . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.03 114.437 -172.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 4.74 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 0.97 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.14 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.575 ' CE1' HG11 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 3.89 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 2.42 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 4.72 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 0.77 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.14 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 1.79 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.408 ' HG ' HD13 ' A' ' 560' ' ' LEU . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 1.63 110.821 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.0 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.462 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 1.74 111.453 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 637' ' ' ASN . . . . . 0.577 ' O ' HG12 ' A' ' 641' ' ' VAL . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.482 ' CG ' HD22 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 2.75 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 641' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 637' ' ' ASN . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 1.39 113.23 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 2.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 2.34 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.52 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 1.65 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 1.6 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 4.45 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 4.34 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.1 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 2.65 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 3.76 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.38 -27.86 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.57 112.241 -174.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.04 59.42 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.186 1.551 . . . . 3.84 115.186 -178.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.8 tt -98.0 -10.09 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 126.026 1.731 . . . . 5.86 113.487 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -107.23 -38.29 6.02 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.057 1.343 . . . . 4.82 112.558 -174.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -72.57 -1.19 15.09 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.059 2.544 . . . . 5.93 115.764 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -75.02 -47.35 29.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.716 1.606 . . . . 6.09 112.092 -167.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 8.2 t70 63.47 177.35 0.16 Allowed 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.54 2.336 . . . . 6.96 116.435 169.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -90.26 -44.54 9.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.705 1.602 . . . . 11.31 112.508 -159.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 41.9 mm 66.03 -48.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 128.033 2.533 . . . . 11.27 117.793 164.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 146.17 60.18 0.02 OUTLIER Glycine 0 N--CA 1.469 0.88 0 C-N-CA 124.687 1.137 . . . . 15.36 110.542 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -144.77 138.02 26.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.413 1.485 . . . . 15.81 110.765 -153.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.4 -23.91 46.52 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.483 1.29 . . . . 24.84 114.483 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -68.44 136.01 52.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.342 1.057 . . . . 19.75 111.286 163.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.7 p -86.3 -52.74 5.44 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.656 1.583 . . . . 21.84 112.867 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.7 pt -146.78 160.29 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.03 1.332 . . . . 25.44 112.885 -166.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -131.9 12.57 4.79 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.358 1.463 . . . . 24.34 113.523 168.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.409 HD12 ' H ' ' A' ' 672' ' ' HIS . 25.0 tp -133.92 169.17 17.49 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.815 1.646 . . . . 27.27 111.106 -177.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.409 ' H ' HD12 ' A' ' 671' ' ' LEU . 36.9 t-80 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 128.342 2.657 . . . . 33.13 115.311 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 CA--C 1.555 1.169 0 N-CA-C 108.988 -0.745 . . . . 5.89 108.988 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t -52.32 -23.77 6.41 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.588 1.555 . . . . 3.35 113.856 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 4.79 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 4.64 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 2.96 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.414 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.41 110.383 169.68 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.03 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 3.91 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 2.55 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.74 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 2.68 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' PHE . . . . . 0.414 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 2.56 114.153 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 2.17 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 3.77 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 1.25 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.44 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 2.43 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 2.21 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 1.78 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 1.36 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 0.87 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 0.84 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 0.89 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 2.56 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 2.71 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.455 HD13 ' HG ' ' A' ' 633' ' ' LEU . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 2.28 111.512 -165.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 2.68 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 2.87 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 0.97 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 2.07 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 2.8 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 1.05 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 1.8 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 6.92 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.42 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 2.86 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 2.42 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.27 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 5.15 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 4.77 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.33 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 3.41 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 2.9 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' A' ' 605' ' ' SER . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 0.85 110.442 -168.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 2.38 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 0.89 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 0.89 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 0.68 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.26 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 3.16 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 2.1 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.28 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.14 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 3.97 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.578 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.578 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 4.33 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 1.92 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 2.06 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 1.12 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.51 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.54 ' HB2' HD12 ' A' ' 584' ' ' ILE . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.05 111.867 173.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 3.45 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 2.28 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 610' ' ' ILE . . . . . 0.428 HG22 HG22 ' A' ' 614' ' ' THR . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 5.54 110.996 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 5.18 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 2.23 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 4.84 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 614' ' ' THR . . . . . 0.428 HG22 HG22 ' A' ' 610' ' ' ILE . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 3.21 109.441 173.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 7.85 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 2.46 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 5.78 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 7.27 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 4.84 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 2.21 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 2.78 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 1.13 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.02 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 0.97 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 0.95 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 2.65 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 2.23 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.1 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.01 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.07 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 1.77 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.455 ' HG ' HD13 ' A' ' 560' ' ' LEU . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 1.39 109.871 -174.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.25 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 2.09 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 2.67 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.32 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 2.18 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 2.37 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.32 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 1.52 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 1.6 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.08 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 650' ' ' ARG . . . . . 0.408 ' HA ' ' HG2' ' A' ' 653' ' ' GLU . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 5.7 112.939 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 1.82 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 2.64 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 653' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 650' ' ' ARG . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.4 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p -67.88 -41.24 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.07 110.5 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -63.32 -17.8 62.93 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.518 1.303 . . . . 3.57 114.518 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 15.9 tt -106.15 -17.02 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.956 1.303 . . . . 6.4 113.998 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -97.13 -31.44 12.47 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.294 -1.504 . . . . 5.6 113.758 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -70.88 6.0 1.73 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.498 2.319 . . . . 5.34 117.15 -171.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.84 7.67 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 128.944 2.898 . . . . 5.96 117.387 -161.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.03 20.75 18.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.96 2.504 . . . . 6.61 114.672 -177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -87.1 8.46 23.54 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.437 1.495 . . . . 13.72 114.311 174.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -41.66 131.13 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 127.928 2.491 . . . . 11.91 114.687 -175.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -85.47 21.91 12.24 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 126.695 2.093 . . . . 17.03 115.721 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.12 8.64 0.13 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 128.076 2.55 . . . . 17.69 117.056 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.11 82.2 0.7 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.645 1.978 . . . . 24.72 111.059 170.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -149.73 160.82 43.23 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.292 1.437 . . . . 24.53 113.221 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 50.7 m -70.98 -56.66 5.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.891 0.876 . . . . 28.74 110.409 162.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.78 155.66 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.147 0.979 . . . . 32.9 112.106 -170.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 28.9 mt -79.5 130.78 35.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.628 0.371 . . . . 30.37 111.101 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 61.0 tp -106.54 137.76 43.96 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.818 1.247 . . . . 33.96 112.233 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 130.729 3.611 . . . . 38.09 117.002 174.831 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 115.241 1.571 . . . . 7.16 115.241 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t -64.14 -41.77 97.06 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.55 113.932 -159.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 5.75 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 5.66 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 2.87 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 1.33 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 1.83 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.03 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 1.87 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 2.53 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 2.93 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 2.04 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 3.71 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 2.0 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.43 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.19 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 2.27 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 2.35 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 1.6 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 1.07 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 1.05 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 1.18 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 1.89 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 2.48 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 2.74 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 1.9 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 2.77 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 1.33 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 2.16 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 0.98 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 2.52 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 1.4 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 1.51 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 7.85 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.07 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.02 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.29 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 5.9 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' LYS . . . . . 0.457 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 3.81 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 2.8 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 582' ' ' TYR . . . . . 0.457 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 3.68 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 3.19 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 605' ' ' SER . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 0.95 110.845 -159.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.79 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 2.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 0.98 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 1.1 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.42 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.11 111.187 173.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.37 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 3.13 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 3.67 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.04 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 594' ' ' LYS . . . . . 0.501 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 4.72 115.874 -162.046 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 4.58 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.25 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 3.59 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 2.43 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 2.67 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 1.1 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 1.59 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.2 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.04 112.084 165.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 3.69 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 2.23 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 609' ' ' GLU . . . . . 0.549 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 610' ' ' ILE . . . . . 0.549 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 6.13 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.13 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 2.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 4.02 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 2.89 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 6.68 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.2 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 4.41 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 6.19 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.08 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 1.78 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 2.47 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 0.96 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.21 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 0.99 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 625' ' ' ASP . . . . . 0.42 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 1.13 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 2.56 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 2.53 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 3.46 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 0.92 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 6.48 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 1.81 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 1.35 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.05 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 2.2 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 4.17 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.89 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 0.94 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 642' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 649' ' ' ARG . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 4.32 112.325 170.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 2.32 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.79 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 1.62 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 2.55 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 649' ' ' ARG . . . . . 0.403 ' HA ' HD21 ' A' ' 642' ' ' LEU . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 4.79 110.115 163.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 7.0 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 1.91 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 2.28 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.55 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.37 -40.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 2.69 111.282 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -60.61 -28.99 68.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.474 0.71 . . . . 2.78 112.109 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.77 -9.0 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 114.855 1.428 . . . . 4.83 114.855 174.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -139.79 -22.55 0.87 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.339 1.427 . . . . 4.73 114.521 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -75.71 -36.5 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.556 1.142 . . . . 6.76 112.259 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.55 -63.96 0.96 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.289 1.436 . . . . 5.28 110.44 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -129.03 131.6 47.39 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.821 2.048 . . . . 8.6 107.861 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -72.44 -41.88 65.66 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.465 0.913 . . . . 12.58 113.465 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 22.0 mm 66.21 -34.72 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 126.417 1.887 . . . . 11.91 115.059 -179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 99.8 69.26 0.89 Allowed Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.512 1.529 . . . . 15.67 113.88 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.82 174.78 11.85 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.677 1.591 . . . . 17.02 112.052 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.58 153.49 28.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.526 1.531 . . . . 22.24 112.224 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -137.72 179.28 6.51 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.724 1.609 . . . . 23.56 110.765 176.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.2 p -68.22 -78.76 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.125 -0.984 . . . . 26.49 110.88 169.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 31.1 pt -143.22 152.25 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.776 2.03 . . . . 29.67 110.628 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -148.78 155.75 41.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.599 1.16 . . . . 26.85 112.321 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 38.7 tp -65.03 137.01 57.44 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.75 0.82 . . . . 29.58 111.759 178.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.258 1.552 0 C-N-CA 129.658 3.183 . . . . 33.61 115.147 -174.783 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.8 p30 . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 110.918 -0.03 . . . . 8.61 110.918 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m 50.41 -135.29 1.39 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.98 1.312 . . . . 6.81 111.871 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 4.53 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 6.7 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 2.56 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 1.76 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 2.57 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.25 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.06 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 3.12 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 2.89 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 4.31 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.32 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.41 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 553' ' ' VAL . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.13 113.495 -178.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 1.79 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 2.64 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 550' ' ' PRO . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 2.35 112.166 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 1.5 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 1.71 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.21 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 1.82 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 2.38 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 2.65 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.16 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 1.88 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 2.71 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 1.34 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 2.4 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.2 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.09 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.61 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 3.28 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 1.26 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 572' ' ' ILE . . . . . 0.442 HG12 HG13 ' A' ' 622' ' ' VAL . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 2.69 110.412 -164.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 11.97 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.32 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 4.09 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.37 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 6.34 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 3.32 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 1.89 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 4.25 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 2.58 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 1.22 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 3.74 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 1.88 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 1.85 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.39 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 3.54 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 2.34 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 2.87 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 4.62 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 3.85 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.8 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.02 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 2.79 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 2.48 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 1.85 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 1.72 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.36 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.18 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 5.48 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 2.9 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 6.73 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.44 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' A' ' 635' ' ' VAL . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 2.59 109.031 174.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 3.46 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 3.96 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 6.89 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 3.88 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 3.67 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 9.46 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 3.55 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 2.24 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.67 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 622' ' ' VAL . . . . . 0.442 HG13 HG12 ' A' ' 572' ' ' ILE . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 1.96 113.616 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 4.47 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 1.62 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.0 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 2.49 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 1.97 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 4.24 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 1.21 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 6.67 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 1.71 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 1.93 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.45 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.446 ' HB ' HD22 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 2.57 111.581 171.498 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.436 ' CG ' HD21 ' A' ' 612' ' ' LEU . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 3.16 111.668 170.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 1.56 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 2.57 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 2.54 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.77 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 1.8 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 2.8 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 4.62 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 6.99 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.82 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 3.25 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -86.37 -36.1 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 4.79 111.881 174.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.3 68.24 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.101 0.778 . . . . 5.29 113.101 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 19.1 tt -77.91 -45.26 27.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 118.728 0.694 . . . . 7.39 112.439 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -74.9 -33.75 62.08 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.927 1.455 . . . . 6.72 114.927 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -74.06 -13.81 60.9 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.031 1.332 . . . . 7.43 113.574 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.51 -24.79 15.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.379 1.871 . . . . 8.73 112.086 161.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.6 t0 59.27 173.51 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.96 2.904 . . . . 12.14 113.88 -171.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -68.06 -46.79 70.12 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 120.676 -1.265 . . . . 19.46 112.408 -171.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 18.8 mm 60.58 -34.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 128.208 2.603 . . . . 17.69 115.635 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 80.8 18.12 71.06 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.733 1.159 . . . . 22.31 112.788 -158.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 145.41 47.62 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.969 1.384 . . . . 22.52 112.42 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.95 121.94 15.31 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.671 0.788 . . . . 31.11 110.265 178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -74.87 137.58 41.88 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.21 1.004 . . . . 28.21 110.996 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 60.8 m -67.05 -60.88 2.25 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.081 0.952 . . . . 30.82 112.967 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 42.6 pt -130.62 155.01 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.45 0.7 . . . . 32.58 112.132 -167.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.17 171.66 7.31 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.833 1.253 . . . . 35.08 112.639 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 65.4 tp -134.4 134.61 41.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.495 1.518 . . . . 36.74 110.526 167.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 . . . . . 0 C--O 1.252 1.218 0 C-N-CA 129.102 2.961 . . . . 42.75 114.811 159.035 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 48.7 t30 . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 121.811 0.815 . . . . 7.42 111.698 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p -86.46 -26.56 24.59 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.408 1.083 . . . . 4.0 112.864 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 5.91 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 4.86 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.03 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 1.15 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 1.62 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.65 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 1.67 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 3.22 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 2.34 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 1.95 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 3.4 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.22 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.29 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.33 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 2.3 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 1.52 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 1.18 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 0.94 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.0 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 1.36 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.08 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 4.53 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 2.59 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 2.3 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 2.29 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 1.34 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 2.12 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.03 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 2.85 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 1.34 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 2.67 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 7.77 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.71 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 2.59 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 2.6 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 1.71 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.23 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 5.34 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.17 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 4.28 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 2.7 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.582 HD12 ' HB2' ' A' ' 605' ' ' SER . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 1.0 110.673 -162.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 3.78 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 4.71 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 0.87 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 0.78 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.37 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 2.82 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 2.37 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 2.94 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.37 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.12 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.557 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 4.38 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.17 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 2.48 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 0.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.46 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.582 ' HB2' HD12 ' A' ' 584' ' ' ILE . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.64 111.738 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 3.93 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 2.52 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 5.72 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.33 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.591 HD23 ' HB ' ' A' ' 635' ' ' VAL 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 3.24 114.224 -164.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 4.98 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.68 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.0 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.24 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 3.53 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 5.44 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 3.38 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 2.0 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 2.34 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 1.38 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 3.75 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 0.82 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 0.86 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG11 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 3.23 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 2.54 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 5.62 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 0.94 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.57 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 2.07 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 1.66 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.43 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.591 ' HB ' HD23 ' A' ' 612' ' ' LEU . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 2.41 111.607 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.414 ' CD1' HD22 ' A' ' 612' ' ' LEU . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 2.28 111.603 172.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.07 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 2.09 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 2.11 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.09 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 2.55 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 2.29 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.05 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 7.14 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 2.16 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 2.61 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.48 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p -86.19 -41.68 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 3.4 111.176 171.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -50.28 -39.16 44.48 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.886 1.274 . . . . 3.16 113.999 -175.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 9.4 tp -76.06 -15.5 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.682 1.593 . . . . 4.64 114.842 -175.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -105.3 -31.33 9.13 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.737 -1.227 . . . . 5.34 111.77 167.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -57.85 -39.73 78.43 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.43 1.892 . . . . 8.77 113.04 177.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -64.66 -15.0 60.62 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.786 1.773 . . . . 6.68 115.786 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -70.66 148.14 48.38 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.188 0.904 . . . . 7.82 113.416 -171.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -95.12 -5.26 44.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.272 2.229 . . . . 14.3 117.015 -164.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.304 0.4 OUTLIER 21.46 -125.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 130.591 3.556 . . . . 12.26 114.672 -169.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -87.38 13.86 59.16 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 124.555 1.074 . . . . 16.64 114.958 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -122.91 -48.21 2.02 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.107 1.151 . . . . 17.8 114.107 -155.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -124.22 -175.41 3.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.84 1.656 . . . . 22.18 111.275 -172.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -108.87 165.76 11.33 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.597 1.159 . . . . 22.64 110.456 173.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.5 m -71.86 -177.98 2.16 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.395 1.078 . . . . 22.26 113.647 -172.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 28.4 pt -61.59 165.79 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.568 1.547 . . . . 24.73 113.959 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.91 134.71 48.71 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.062 0.945 . . . . 26.48 110.804 170.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.38 159.3 23.68 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.13 1.372 . . . . 29.29 113.863 -171.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 72.0 t60 . . . . . 0 C--O 1.257 1.493 0 C-N-CA 128.144 2.578 . . . . 34.91 115.096 -162.166 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 8.7 p30 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 114.372 1.249 . . . . 5.63 114.372 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m 60.44 -17.05 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.6 118.991 168.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.32 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.01 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 2.54 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.03 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 1.4 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 2.57 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.75 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 2.75 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 2.09 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 1.76 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 2.88 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.23 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.43 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 2.43 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 2.3 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 1.57 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 1.09 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 1.07 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 0.96 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 0.95 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 2.55 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 2.87 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 560' ' ' LEU . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.04 113.74 -151.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 2.28 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 2.63 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 0.9 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.422 ' CG ' HG22 ' A' ' 571' ' ' ILE . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 2.09 111.583 165.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.61 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.42 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 2.97 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.422 HG22 ' CG ' ' A' ' 565' ' ' PHE . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 1.64 114.658 -169.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 1.95 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 8.83 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 575' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 3.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.16 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.62 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 4.42 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 4.28 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.18 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 2.65 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 2.84 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 605' ' ' SER . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 0.71 110.92 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 2.81 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 1.04 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 0.92 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.41 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 3.13 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 1.93 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 2.66 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 4.57 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 5.55 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 2.47 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 2.33 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 0.97 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 1.7 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.43 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.462 ' HB2' HD12 ' A' ' 584' ' ' ILE . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.11 111.204 164.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 3.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 2.29 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 6.7 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 6.84 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 2.35 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 4.65 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 2.74 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 7.49 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.04 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 3.56 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 8.13 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.19 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 2.04 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 1.98 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 1.35 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.12 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 0.95 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 1.38 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 2.49 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 2.32 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.13 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 0.74 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.08 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 2.61 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 1.5 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 2.98 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 2.58 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 2.54 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 1.39 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 642' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 642' ' ' LEU . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 1.93 114.722 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 2.59 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.6 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 2.14 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 1.6 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 3.99 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 5.47 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 1.62 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 2.43 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.45 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 3.6 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.01 -33.48 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 2.89 111.754 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.42 -20.59 7.78 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.892 1.277 . . . . 3.48 114.426 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.0 tt -122.15 -34.83 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 125.024 1.329 . . . . 5.9 113.168 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -69.82 -27.46 64.89 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.052 1.341 . . . . 5.81 113.723 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -72.51 -8.89 57.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.807 -1.183 . . . . 5.68 113.85 173.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 18.9 mt -97.63 -56.53 2.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.854 1.661 . . . . 5.28 110.668 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -139.6 127.94 22.72 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.101 1.76 . . . . 7.35 109.614 166.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 42.0 ptt85 -75.61 1.09 15.33 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 116.066 1.876 . . . . 12.75 116.066 -170.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.68 141.29 46.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.801 2.441 . . . . 13.01 111.279 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -84.26 -42.83 7.3 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.329 1.443 . . . . 17.15 115.846 -171.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt 51.11 64.22 1.93 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.498 1.519 . . . . 18.57 114.046 170.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -43.23 159.34 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.169 3.388 . . . . 25.56 116.648 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.29 -34.42 25.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.671 1.588 . . . . 25.46 112.163 176.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 10.0 p -151.7 -60.36 0.17 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.11 1.364 . . . . 28.42 112.908 171.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.6 pt -146.65 167.41 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.485 1.914 . . . . 32.26 110.245 -174.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.6 mt -88.24 159.39 18.15 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.62 0.724 . . . . 30.39 112.303 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 41.0 tp -81.33 122.32 27.32 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.907 0.883 . . . . 32.76 110.75 170.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.256 1.427 0 C-N-CA 127.823 2.449 . . . . 37.7 114.341 165.417 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 121.718 0.77 . . . . 7.82 112.586 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m -75.74 15.35 0.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.73 116.366 -164.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 4.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 4.43 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 2.4 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 1.75 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.25 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 3.65 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.27 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 3.55 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.0 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 2.53 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 2.02 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.21 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 1.25 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.06 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 1.8 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 1.92 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 1.44 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 0.81 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 0.71 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 0.75 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 0.85 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 1.63 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 2.81 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.436 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 1.98 113.401 -166.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 2.36 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 2.18 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' A' ' 629' ' ' ARG . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.01 111.985 175.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.417 ' CG ' HG22 ' A' ' 571' ' ' ILE . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 2.14 111.777 168.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.27 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 3.68 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.417 HG22 ' CG ' ' A' ' 565' ' ' PHE . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 1.17 112.869 -175.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 2.52 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 8.29 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 2.96 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 3.07 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 4.34 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 582' ' ' TYR . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 4.93 113.519 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.39 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' TYR . . . . . 0.417 ' CE2' ' HE3' ' A' ' 580' ' ' LYS . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 2.75 111.78 -174.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 2.82 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.497 HD12 ' HB2' ' A' ' 605' ' ' SER . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.0 111.77 -165.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 3.58 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 0.99 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 0.93 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 0.72 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.61 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 3.29 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 1.8 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 2.96 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 5.58 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 4.95 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.496 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 4.29 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 2.35 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 2.15 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 1.07 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 1.6 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.497 ' HB2' HD12 ' A' ' 584' ' ' ILE . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.17 111.325 167.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 8.64 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 607' ' ' PHE . . . . . 0.411 ' CZ ' HD11 ' A' ' 584' ' ' ILE . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 2.5 115.476 -173.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 610' ' ' ILE . . . . . 0.483 HG21 HG23 ' A' ' 614' ' ' THR . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 6.52 114.386 168.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.63 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.761 HD23 HG22 ' A' ' 635' ' ' VAL . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.08 114.578 -169.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 3.57 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 614' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 610' ' ' ILE . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 2.88 112.859 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 7.64 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 2.68 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.03 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 6.81 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 3.6 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 1.87 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 2.17 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 1.32 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.37 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.06 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.27 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 3.2 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 2.5 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 629' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 564' ' ' VAL . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.12 108.382 169.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 0.98 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 7.71 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 1.45 108.836 -171.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.761 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 2.58 111.984 -176.67 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 2.57 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 0.9 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 1.96 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 1.95 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.14 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.04 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 1.91 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 6.58 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 4.7 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 1.75 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 2.94 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.79 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p -88.27 -31.47 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 2.91 112.133 177.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.04 63.7 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.586 0.958 . . . . 3.69 113.586 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -75.34 -10.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 114.161 1.171 . . . . 5.54 114.161 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -99.82 -34.15 10.27 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.946 1.699 . . . . 5.86 111.693 169.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -75.49 -2.6 29.65 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.814 1.246 . . . . 8.22 113.578 172.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.3 -24.11 65.72 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.661 1.984 . . . . 5.24 112.852 166.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -61.47 168.49 2.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.511 1.524 . . . . 8.01 114.504 -173.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 41.4 mtm180 -50.05 3.18 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 131.037 3.735 . . . . 11.99 118.407 -174.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 15.4 mm -53.43 111.87 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 126.297 1.839 . . . . 14.16 114.594 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 71.8 -9.47 4.95 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.672 1.606 . . . . 18.23 114.969 -174.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.252 0.0 OUTLIER -114.71 21.39 14.48 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.467 1.907 . . . . 16.96 114.652 178.063 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 50.7 tttm -63.65 136.12 57.26 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.157 1.383 . . . . 22.23 111.01 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 20.2 m120 57.04 -10.54 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.018 2.527 . . . . 22.85 116.395 -173.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 14.7 m -76.45 134.17 39.64 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.114 1.766 . . . . 24.15 112.362 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 7.6 pt 49.83 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 129.034 2.934 . . . . 26.95 117.749 175.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.4 165.33 13.62 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.342 1.857 . . . . 28.14 112.176 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.65 134.61 47.12 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.717 2.007 . . . . 28.56 112.167 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 59.9 t60 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 126.492 1.917 . . . . 34.14 113.186 163.562 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.055 0.761 . . . . 7.33 113.055 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t -55.88 -25.68 43.66 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.94 -1.1 . . . . 4.03 113.543 -178.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 5.81 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 4.56 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 2.7 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 539' ' ' VAL . . . . . 0.408 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.0 111.405 176.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.4 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 2.72 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.01 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 3.5 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' PHE . . . . . 0.408 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 2.27 112.061 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 1.8 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.08 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 1.28 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.8 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 3.39 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 2.16 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 2.85 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 1.15 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 0.86 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 0.77 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 0.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 2.22 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 2.99 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 2.43 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 1.83 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 2.35 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 0.96 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 2.35 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.48 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.08 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 2.64 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 1.13 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 622' ' ' VAL . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 2.54 111.8 -168.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 10.62 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.3 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 4.32 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 4.23 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 5.88 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 4.28 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 1.82 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 3.19 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 2.46 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.464 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 0.77 110.761 -165.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 3.77 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.83 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 588' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' A' ' 626' ' ' THR . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 0.86 109.033 176.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.433 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 0.75 110.818 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 2.56 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 2.34 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.07 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.33 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 6.62 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 2.77 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 1.95 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 1.13 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.54 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.06 114.129 177.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 6.75 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 2.31 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 7.59 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 6.26 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 2.24 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 5.18 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 4.56 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 6.98 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.1 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 6.87 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 5.75 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 4.65 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 1.94 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.19 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 622' ' ' VAL . . . . . 0.426 HG13 ' CG1' ' A' ' 572' ' ' ILE . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 0.91 115.625 -178.055 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 4.95 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 0.74 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 625' ' ' ASP . . . . . 0.433 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 626' ' ' THR . . . . . 0.406 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 0.86 110.186 -167.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 2.97 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.24 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.01 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 0.82 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.37 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 2.45 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 1.54 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 1.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.4 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 2.88 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.09 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 2.31 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 2.15 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.15 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 1.97 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 1.88 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.08 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 7.97 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.25 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 3.21 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.46 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.66 -34.47 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.45 110.851 177.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.34 60.8 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.812 1.412 . . . . 3.87 114.812 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.6 tt -95.25 -20.85 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.9 1.28 . . . . 4.77 113.376 173.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -95.05 -31.85 13.4 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.772 -1.205 . . . . 5.36 113.59 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -73.22 -1.07 16.25 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.214 2.206 . . . . 5.75 112.625 168.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.5 tp -102.21 -65.98 0.95 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.967 2.507 . . . . 5.17 112.597 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -102.23 159.8 15.09 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.707 1.203 . . . . 6.75 112.227 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.82 -43.65 9.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.064 0.946 . . . . 12.11 111.613 168.052 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 26.9 mm 61.46 -45.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 128.795 2.838 . . . . 11.64 114.23 -170.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 170.86 -90.61 0.09 OUTLIER Glycine 0 CA--C 1.528 0.894 0 C-N-CA 129.655 3.502 . . . . 14.46 106.762 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt 59.07 156.53 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 129.844 3.258 . . . . 17.2 116.179 173.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -157.74 144.48 17.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.196 2.198 . . . . 24.16 109.764 175.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -156.34 146.15 21.06 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.217 0.821 . . . . 24.4 113.217 -172.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 83.7 p -68.13 177.44 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.07 1.348 . . . . 27.75 114.264 176.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.5 159.43 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.849 1.66 . . . . 33.71 113.45 -170.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 61.0 tp -100.86 108.02 19.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.58 1.552 . . . . 32.9 109.522 175.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.77 168.13 14.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.781 1.232 . . . . 36.86 112.872 -171.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.57 1.948 . . . . 42.38 112.665 -177.801 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 120.794 0.33 . . . . 8.53 111.672 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p -75.64 35.86 0.13 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 3.3 116.471 -160.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 4.67 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 4.57 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 2.48 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 1.88 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.13 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.6 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 2.98 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 2.88 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 2.74 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 2.45 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.14 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 2.84 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 1.14 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.21 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 1.94 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 2.09 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 2.83 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.06 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 0.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 0.95 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 1.09 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 1.92 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 4.89 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 561' ' ' LYS . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 2.28 110.056 -173.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 561' ' ' LYS . . . . . 0.512 ' N ' HD23 ' A' ' 560' ' ' LEU . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.13 111.937 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 3.4 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 1.24 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' PHE . . . . . 0.413 ' CG ' HG22 ' A' ' 571' ' ' ILE . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 2.06 111.666 168.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.65 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.24 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 2.78 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.413 HG22 ' CG ' ' A' ' 565' ' ' PHE . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 0.93 115.409 -160.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 1.48 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 7.41 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.56 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 2.86 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 2.58 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.74 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 4.72 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.17 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 1.95 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 2.49 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 2.75 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 1.48 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.1 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 2.75 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.23 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 0.99 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 0.72 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.25 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 591' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 599' ' ' MET . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 2.59 107.812 -141.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 1.78 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 2.6 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 5.37 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.49 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 4.66 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 599' ' ' MET . . . . . 0.508 ' O ' HG12 ' A' ' 591' ' ' VAL . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 2.84 110.33 162.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 2.43 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 1.19 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.51 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.8 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.64 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.01 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 2.19 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.14 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 6.31 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.795 HD23 HG22 ' A' ' 635' ' ' VAL . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 1.95 114.574 167.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.06 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.17 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 6.57 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.58 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.1 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 5.62 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 3.33 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.05 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 2.77 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.01 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 4.58 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 0.92 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.14 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 4.0 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 2.81 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 3.67 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 1.35 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.05 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.52 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 3.07 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.44 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 635' ' ' VAL . . . . . 0.795 HG22 HD23 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 2.8 109.584 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 2.58 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.448 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 2.64 109.447 168.33 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 0.93 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 2.29 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 2.25 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.36 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 2.31 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 1.66 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.16 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 6.97 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 1.79 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 2.34 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.63 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.86 -33.81 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 3.61 111.945 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -61.22 -10.29 6.45 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.59 1.33 . . . . 3.92 114.59 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 8.1 tp -115.04 -33.34 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.365 1.466 . . . . 5.39 112.978 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.57 -31.1 71.97 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 120.507 -1.37 . . . . 6.41 113.532 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -90.26 -15.76 30.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.629 2.371 . . . . 8.3 113.201 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 10.0 tt -80.87 -41.11 23.66 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.372 1.469 . . . . 7.05 112.637 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -150.26 145.64 26.32 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.228 -0.92 . . . . 9.19 111.911 170.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -84.4 -20.05 32.51 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.128 1.371 . . . . 15.46 114.109 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 24.3 mm 63.15 -33.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 128.737 2.815 . . . . 14.98 117.258 172.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 102.6 28.49 6.3 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 125.882 1.706 . . . . 19.71 112.806 -156.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -136.4 166.81 22.61 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.151 1.78 . . . . 19.94 111.899 -178.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -154.23 101.88 2.42 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.48 1.112 . . . . 26.46 111.93 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.26 -24.41 32.3 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.534 2.334 . . . . 25.92 112.769 178.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -62.86 166.85 5.17 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.457 1.103 . . . . 27.88 113.89 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 14.6 pt -69.78 151.73 9.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 125.23 1.412 . . . . 32.3 114.402 -166.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.06 9.3 24.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.912 1.685 . . . . 35.38 113.669 171.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -81.44 113.0 19.21 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.131 1.372 . . . . 38.07 109.144 176.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 127.089 2.155 . . . . 42.67 114.421 -179.597 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 113.473 0.916 . . . . 7.89 113.473 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -76.05 -15.0 60.2 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 -167.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 4.83 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 3.75 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 2.13 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 1.38 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.19 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.51 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.68 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 2.8 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 2.26 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 1.67 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 1.41 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.57 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 1.96 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 1.43 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 1.04 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 0.8 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' MET . . . . . 0.553 ' HG3' HG11 ' A' ' 641' ' ' VAL . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 1.56 114.512 171.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 0.86 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 2.02 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 2.55 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 633' ' ' LEU . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 2.21 112.311 -157.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 3.4 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 3.05 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.438 HG11 ' CE1' ' A' ' 627' ' ' TYR . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 1.16 111.776 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 1.92 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.53 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 4.02 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 1.16 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 1.73 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 7.15 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.59 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 2.94 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.21 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.05 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 4.93 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 6.63 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 2.31 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 5.46 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 2.68 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.583 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 1.2 111.458 -170.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 2.54 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.14 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 1.02 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 0.86 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.08 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.02 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 2.46 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.23 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 4.87 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 4.99 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 3.34 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.03 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 2.26 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 1.26 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 2.52 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.583 ' HB2' HD12 ' A' ' 584' ' ' ILE . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 3.81 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 2.21 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 8.44 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 6.14 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 2.21 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 4.44 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 4.42 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.12 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.48 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 4.45 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 7.05 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 3.99 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 1.9 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 2.76 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.11 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 5.12 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.17 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 1.29 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.438 ' CE1' HG11 ' A' ' 564' ' ' VAL . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 2.66 108.577 170.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 2.75 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.26 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 1.33 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.55 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 1.79 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.492 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 1.36 111.062 -177.55 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.28 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 1.9 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 637' ' ' ASN . . . . . 0.686 ' O ' HG12 ' A' ' 641' ' ' VAL . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.18 112.775 174.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 2.78 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 641' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 637' ' ' ASN . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 1.23 112.633 -172.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 2.24 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 2.07 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.43 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.26 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 2.26 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 6.49 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 6.69 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 1.65 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 2.61 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.7 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p -59.34 -36.37 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 3.05 111.02 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.69 -1.73 0.93 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.934 1.828 . . . . 4.62 115.934 173.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.1 tt -127.78 -28.05 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.155 1.382 . . . . 5.42 113.006 166.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -65.57 -38.05 88.43 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.94 -1.725 . . . . 4.03 112.751 172.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -82.36 -15.57 52.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.614 1.966 . . . . 5.31 113.413 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -93.23 -7.56 44.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.46 1.504 . . . . 7.4 112.698 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 29.8 t0 61.36 173.09 0.11 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.783 2.033 . . . . 9.72 114.189 -172.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -51.9 -60.81 2.75 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.341 1.856 . . . . 14.15 112.793 -175.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 33.6 mm 58.02 147.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.768 2.427 . . . . 16.16 113.464 -175.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -72.23 96.12 0.7 Allowed Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.731 -1.231 . . . . 20.03 110.615 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -91.81 151.96 20.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.886 0.843 . . . . 22.31 112.774 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -82.98 163.91 20.73 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.898 1.279 . . . . 27.73 112.126 165.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -62.18 -47.82 82.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.559 0.948 . . . . 28.9 113.559 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 69.0 m 54.44 -161.04 0.15 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.945 1.298 . . . . 30.31 114.337 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 38.6 pt -69.98 157.63 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.189 2.195 . . . . 31.93 114.356 -170.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.62 178.07 8.39 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.995 0.918 . . . . 35.17 113.046 174.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -142.77 125.0 15.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.08 0.952 . . . . 34.04 110.641 166.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 36.2 t60 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 128.021 2.529 . . . . 40.04 114.658 176.042 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 113.866 1.061 . . . . 8.88 113.866 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t -53.68 -41.87 67.34 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.352 -0.842 . . . . 3.39 113.084 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 4.4 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 3.96 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 3.18 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 1.21 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 1.47 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.12 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.09 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.26 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 2.67 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 2.16 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 1.8 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 1.1 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.04 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 1.84 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 1.86 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 1.37 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 0.93 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.02 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 1.42 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 1.32 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.51 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 5.04 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 2.63 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 1.99 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 2.55 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 0.94 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 2.04 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.32 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 2.66 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 1.21 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.04 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 8.59 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.23 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 2.18 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.48 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 3.99 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 3.63 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 1.99 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 2.6 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 3.6 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.52 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.19 110.287 -161.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 2.66 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 0.92 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 588' ' ' VAL . . . . . 0.437 ' H ' ' CG2' ' A' ' 626' ' ' THR . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 0.99 108.117 171.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 0.71 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.1 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 2.9 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 1.63 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.51 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 6.39 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 3.8 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.69 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 597' ' ' LYS . . . . . 0.421 ' H ' ' CD ' ' A' ' 597' ' ' LYS . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 6.34 116.306 -168.685 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 1.73 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 2.36 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 1.66 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.54 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.42 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 584' ' ' ILE . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.18 111.852 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 4.06 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 2.76 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 2.66 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 609' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 610' ' ' ILE . . . . . 0.44 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.18 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 7.38 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 3.75 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 3.74 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.12 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 10.03 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.26 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 3.84 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 7.39 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 3.43 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 1.97 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 1.85 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 0.95 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 3.97 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 1.04 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 626' ' ' THR . . . . . 0.437 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 1.48 109.306 -175.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 3.66 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 2.37 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 3.25 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 0.8 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.03 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 1.71 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 1.43 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.5 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 2.66 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 2.53 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.17 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 1.12 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 1.86 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 2.41 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 1.87 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 2.28 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 2.06 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 4.88 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 5.07 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.42 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 2.79 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 4.65 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -104.53 -36.42 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.63 111.745 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.1 65.51 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.044 1.128 . . . . 4.92 114.044 175.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.1 tt -77.69 -17.98 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.081 1.352 . . . . 8.02 113.369 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -119.53 -39.86 2.84 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.437 1.495 . . . . 7.32 113.563 -158.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 39.0 ptt85 -68.91 -26.32 65.04 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 115.729 1.751 . . . . 8.47 115.729 -170.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.1 tp -98.97 -41.02 7.77 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.832 0.853 . . . . 6.38 113.297 -158.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -66.03 159.06 26.74 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.36 0.874 . . . . 11.96 113.36 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -67.18 7.81 0.37 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.037 2.935 . . . . 14.44 117.883 -161.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 21.3 mm -80.77 143.2 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 125.873 1.669 . . . . 12.78 109.625 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -75.09 120.5 6.23 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.261 1.41 . . . . 14.41 111.725 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -93.48 128.37 39.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.978 0.911 . . . . 15.13 111.09 -169.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -71.07 -29.51 65.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.981 0.809 . . . . 22.79 112.749 176.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -67.02 127.76 33.8 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.406 1.482 . . . . 21.07 112.368 174.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 49.0 m -85.41 -169.22 2.54 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.202 1.401 . . . . 22.03 112.677 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.4 pt -65.76 152.66 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 120.68 -1.262 . . . . 26.11 113.033 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 55.4 tp -80.48 140.79 35.74 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.328 1.451 . . . . 26.87 111.524 -177.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.464 ' CD1' ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -145.44 -179.77 6.88 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.172 1.789 . . . . 31.51 111.165 -177.455 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.464 ' H ' ' CD1' ' A' ' 671' ' ' LEU . 8.1 t60 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 126.916 2.086 . . . . 37.64 111.678 173.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 116.466 2.024 . . . . 8.69 116.466 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.37 -33.65 71.45 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.432 -1.417 . . . . 3.63 113.866 -179.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 4.46 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.0 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 2.43 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.12 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 1.57 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 2.77 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.59 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 3.49 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 2.28 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 1.7 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 2.99 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 1.35 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.22 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.32 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 2.19 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 1.57 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.08 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 0.77 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 0.92 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 1.06 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.02 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 559' ' ' LYS . . . . . 0.423 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 2.43 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.421 HD13 ' HG ' ' A' ' 633' ' ' LEU . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 2.3 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 561' ' ' LYS . . . . . 0.412 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.24 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 2.51 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 564' ' ' VAL . . . . . 0.529 HG11 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 0.92 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 2.66 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 2.76 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.17 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 1.89 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 7.47 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 2.97 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 2.47 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 1.75 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 579' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 579' ' ' LYS . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 4.4 113.056 -167.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.28 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 2.23 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 3.03 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 2.48 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.449 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.29 109.627 -172.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 3.2 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.27 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 1.34 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.09 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.39 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.03 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 2.37 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.04 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 594' ' ' LYS . . . . . 0.532 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 5.93 115.87 -161.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.74 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.14 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.28 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 2.38 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 1.56 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 1.76 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.65 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 605' ' ' SER . . . . . 0.449 ' HB2' HD12 ' A' ' 584' ' ' ILE . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.32 110.583 160.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 3.82 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 2.71 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 7.47 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 638' ' ' PHE . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 3.05 112.898 -164.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 6.67 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 4.32 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 8.2 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.09 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 6.53 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 2.98 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 1.47 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 1.81 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 0.99 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 3.48 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.14 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.34 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 627' ' ' TYR . . . . . 0.529 ' CE1' HG11 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 3.25 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 2.61 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 4.62 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 1.16 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.32 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 2.34 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.421 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 2.56 112.02 -178.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.64 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 1.77 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 638' ' ' PHE . . . . . 0.41 ' CE1' HD11 ' A' ' 612' ' ' LEU . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 2.93 111.438 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 1.05 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 2.58 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 2.25 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.65 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 1.66 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 1.97 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 4.3 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 5.44 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.16 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 2.76 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.49 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.51 -36.66 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 3.42 111.706 173.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -69.07 7.18 0.76 Allowed 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.073 1.508 . . . . 3.2 115.073 177.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 21.3 tt -127.84 -40.25 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.127 0.971 . . . . 5.09 112.6 158.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -58.87 -38.13 78.1 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 120.13 1.332 . . . . 4.58 112.629 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 -75.22 -5.57 45.2 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.186 1.794 . . . . 6.75 113.616 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -100.3 -9.01 22.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.453 1.501 . . . . 6.1 113.3 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.53 -160.85 0.23 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.753 1.221 . . . . 7.75 112.268 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -64.66 -13.77 55.38 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 119.347 -2.096 . . . . 11.77 115.297 -173.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.261 2.6 pp -82.74 -10.86 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 114.107 1.151 . . . . 11.31 114.107 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -71.91 94.68 0.61 Allowed Glycine 0 CA--C 1.533 1.185 0 N-CA-C 109.975 -1.25 . . . . 13.86 109.975 162.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -140.47 25.05 2.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.523 1.675 . . . . 16.3 115.523 -158.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -56.75 -36.66 70.03 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.846 1.259 . . . . 23.65 113.735 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -152.63 142.53 22.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.02 0.928 . . . . 22.01 112.288 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.1 t -83.43 -59.04 2.58 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.264 0.625 . . . . 22.45 112.592 173.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.4 pt -140.69 162.02 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.206 1.403 . . . . 27.87 112.921 -167.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -150.2 165.54 32.59 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.886 1.069 . . . . 28.6 113.886 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.555 HD13 ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -66.47 158.12 30.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.498 1.519 . . . . 33.86 113.271 -175.298 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 672' ' ' HIS . . . . . 0.555 ' H ' HD13 ' A' ' 671' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 128.757 2.823 . . . . 37.42 113.359 170.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 116.017 1.858 . . . . 3.82 116.017 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 6.48 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.32 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 3.78 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 1.55 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 2.5 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.49 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 3.49 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.16 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 2.39 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 3.26 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 3.97 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 1.87 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.25 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 2.8 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 1.49 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 1.17 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 1.1 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 1.14 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 1.31 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 1.85 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 2.61 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 2.71 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 1.83 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 2.85 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.443 HG11 ' CE1' ' A' ' 627' ' ' TYR . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 0.99 111.793 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 2.31 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.47 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 3.18 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 1.24 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 2.51 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 9.79 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 3.28 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 3.65 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 1.92 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 4.47 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 4.48 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.24 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 2.37 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 2.91 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.419 HD11 ' CE2' ' A' ' 607' ' ' PHE . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 1.01 111.885 -159.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 2.82 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.88 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 1.11 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 1.07 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.4 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . 0.443 HG13 ' HB2' ' A' ' 599' ' ' MET . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 2.5 107.743 -140.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 2.49 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.47 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.35 114.664 -169.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.78 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 5.45 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . 0.443 ' HB2' HG13 ' A' ' 591' ' ' VAL . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 2.65 110.739 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 2.84 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 1.57 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 1.83 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.404 ' HB2' HD12 ' A' ' 584' ' ' ILE . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.46 113.502 175.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 6.15 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 584' ' ' ILE . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 2.3 113.835 175.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 7.84 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 5.73 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.764 HD23 HG22 ' A' ' 635' ' ' VAL . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.43 113.349 174.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 4.82 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 4.81 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 6.89 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.32 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 3.62 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 5.63 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 3.44 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 2.17 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.11 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 1.51 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 4.87 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 1.16 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.01 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.443 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 3.84 106.921 164.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 1.96 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 3.58 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 1.04 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.24 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 2.07 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 2.33 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.03 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.764 HG22 HD23 ' A' ' 612' ' ' LEU . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 2.59 110.89 -174.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.437 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 3.01 109.322 161.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 1.49 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 2.61 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 2.51 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.49 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 2.84 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 2.51 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 3.88 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 5.3 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 2.75 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 3.63 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 4.88 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.47 112.493 176.148 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 114.661 1.356 . . . . 4.08 114.661 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 3.79 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.25 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 2.42 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.11 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 1.43 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 2.79 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 1.87 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 2.41 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 2.13 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 1.6 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.76 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 0.98 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.06 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 1.8 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 1.83 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 1.34 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 0.97 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 0.81 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 0.84 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 0.94 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 1.88 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 2.67 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 2.4 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 1.83 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 2.35 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.505 HG11 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 0.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 1.85 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.89 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 2.3 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.419 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 0.87 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 1.46 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 7.42 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.02 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 3.2 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.09 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 4.24 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 3.42 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 1.96 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 2.4 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 2.78 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 605' ' ' SER . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 0.81 110.336 -166.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 2.99 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.75 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 0.76 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 0.66 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.06 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 599' ' ' MET . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 2.57 107.628 -142.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 1.54 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.18 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.0 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.58 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.498 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.498 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 4.39 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . 0.465 ' O ' HG12 ' A' ' 591' ' ' VAL . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 1.68 111.825 -169.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 1.91 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 0.97 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 1.65 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.09 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.471 ' HB2' HD12 ' A' ' 584' ' ' ILE . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.91 111.862 172.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 3.55 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 2.3 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.0 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 7.26 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.433 HD11 ' CD1' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 3.24 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 4.43 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 3.55 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 6.38 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.82 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.1 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 10.33 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.01 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.45 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 3.33 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 0.89 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.2 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 0.77 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 0.97 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.505 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 3.17 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 2.47 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 4.4 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 0.86 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 7.52 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.22 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 1.5 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.16 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 1.86 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.433 ' CD1' HD11 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 2.54 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 0.92 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 2.97 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 2.19 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.66 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 1.89 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 1.63 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 5.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 6.66 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.06 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 2.76 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.19 111.755 176.542 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 7.6 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 7.26 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 2.23 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 1.73 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.01 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.45 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.45 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.07 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 2.41 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 2.37 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 1.94 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 2.75 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.06 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' A' ' 553' ' ' VAL . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.35 113.962 -177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 1.88 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 2.59 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 550' ' ' PRO . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 2.59 112.498 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 0.95 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 0.74 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.15 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 0.99 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 1.87 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 2.54 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.51 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 2.17 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . 0.51 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.01 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 2.32 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 0.79 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 2.43 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.19 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 3.44 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.427 HD12 ' CZ ' ' A' ' 607' ' ' PHE . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 1.57 112.737 -173.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 2.8 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 9.24 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 4.69 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.13 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 2.55 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 2.49 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 1.88 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 4.83 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 6.12 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.37 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 2.71 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 3.45 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 1.03 109.639 -155.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 2.27 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 1.38 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 0.95 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 2.6 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 2.2 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 2.8 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.23 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 4.76 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 4.78 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 2.27 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 2.19 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 1.51 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.47 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.62 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.36 111.963 170.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 3.93 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 571' ' ' ILE . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 3.13 110.36 176.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.77 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 5.33 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 5.47 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 3.21 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 3.83 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.34 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.05 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.1 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 5.37 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 7.39 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.07 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 2.35 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 1.97 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 0.88 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 5.16 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 0.82 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.11 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 3.0 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 2.21 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 2.92 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 1.13 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.01 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 2.69 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 1.48 106.236 174.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 2.55 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 2.63 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 1.57 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 2.2 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 2.7 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.46 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 1.69 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 2.04 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 6.42 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 5.46 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 1.46 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 2.07 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.54 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.47 111.201 -174.119 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.546 0.824 0 N-CA-C 114.914 1.45 . . . . 3.62 114.914 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 3.9 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 4.58 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 3.55 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 1.9 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.56 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 4.59 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 2.97 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.27 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 2.68 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 2.86 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 2.46 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 2.93 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 1.69 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.76 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.28 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 2.08 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 1.91 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 1.14 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 0.81 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.12 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 1.31 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.0 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.08 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.452 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 2.18 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 1.89 112.611 -173.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 2.84 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.535 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 1.04 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 2.18 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.1 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.24 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 2.36 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.34 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 1.83 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 8.17 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.03 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.24 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 3.22 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.26 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.23 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 3.43 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 2.55 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 2.84 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 3.31 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 0.88 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 2.56 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 0.98 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 0.75 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 0.72 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 2.79 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 2.55 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.34 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . 0.415 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.12 110.287 172.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 6.62 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 4.99 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 2.8 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 1.71 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 1.24 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 1.81 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.3 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 3.86 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 2.24 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.21 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 6.22 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.492 HD23 ' HB ' ' A' ' 635' ' ' VAL . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 3.06 115.96 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.06 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 2.86 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 8.04 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 2.88 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 3.9 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 6.44 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 4.09 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 2.17 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.18 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 1.05 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 3.71 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 0.81 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 0.86 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.535 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 3.11 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 2.27 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 2.81 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 0.87 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 6.6 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.14 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 1.27 110.438 -170.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.492 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 1.87 111.28 -172.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' A' ' 612' ' ' LEU . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 2.49 111.468 175.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 0.97 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 2.34 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 2.23 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 1.99 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . 0.526 ' HA ' ' HB3' ' A' ' 651' ' ' ALA . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 2.69 110.787 -177.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 4.84 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 5.91 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 648' ' ' MET . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 2.09 112.961 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 2.41 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.02 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.04 112.622 178.381 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 3.78 116.899 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 5.63 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 5.92 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 2.16 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.17 111.097 172.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 1.56 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 2.95 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.64 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.72 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 3.39 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 2.41 112.337 -178.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 1.67 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 2.85 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.477 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 1.1 114.466 -168.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.43 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 2.48 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 2.3 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.477 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 1.57 112.134 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 1.54 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 1.13 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 0.76 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 1.16 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 2.87 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 2.74 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 2.67 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 2.86 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 2.13 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 0.84 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 2.14 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.9 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 2.49 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.07 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 1.65 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 7.44 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 2.7 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.05 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.65 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 7.35 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 3.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.25 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 3.04 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 2.81 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 0.78 111.463 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 2.6 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.23 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 0.92 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 0.7 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.13 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 2.52 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 2.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.33 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 4.5 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 3.88 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 3.59 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.1 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 1.87 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 2.19 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 0.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 1.66 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.12 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.85 112.392 174.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 3.63 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 2.27 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 5.8 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 5.09 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.785 HD23 HG22 ' A' ' 635' ' ' VAL . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 2.17 115.331 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 4.3 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 3.49 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 7.95 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 1.91 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 3.71 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 6.38 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 3.14 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 1.64 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.58 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 0.92 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 4.69 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 0.72 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 0.86 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 3.21 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.09 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 3.96 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 1.04 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.25 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 1.98 113.364 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 1.38 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.785 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 2.62 110.902 176.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 2.94 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.2 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.06 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 2.42 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.67 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 1.79 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 1.88 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 4.79 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 5.28 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 1.52 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 2.49 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 2.55 113.068 -179.051 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 121.245 0.545 . . . . 7.99 112.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 6.1 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.17 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 2.89 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.473 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 1.16 111.43 177.34 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 1.59 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.61 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 1.91 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 2.45 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . 0.473 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 2.25 113.448 175.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 1.64 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 2.73 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 1.04 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.08 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.03 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 2.15 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 1.42 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 0.9 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 0.73 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.1 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 0.96 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 1.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 2.8 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 2.63 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 3.25 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 2.95 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.56 HG11 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 1.24 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.43 ' CD2' HG22 ' A' ' 571' ' ' ILE . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 2.51 111.316 167.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 2.31 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.43 HG22 ' CD2' ' A' ' 565' ' ' PHE . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 1.34 113.119 -169.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 1.82 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 7.3 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 3.91 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 2.83 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 2.33 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.75 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 4.42 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.02 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 1.74 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 2.92 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 2.52 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.527 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 0.84 110.699 -164.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.03 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.06 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 1.27 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 0.82 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 599' ' ' MET . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 2.62 108.582 -138.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 2.68 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.05 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 5.87 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.38 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 3.86 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . 0.451 ' O ' HG12 ' A' ' 591' ' ' VAL . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 1.87 112.14 -169.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 2.33 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 0.94 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 3.46 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.527 ' HB2' HD12 ' A' ' 584' ' ' ILE . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 0.94 112.688 175.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 3.41 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 2.23 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 8.3 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 5.13 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 635' ' ' VAL . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.25 114.005 -163.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 5.4 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 3.86 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.08 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.03 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 3.46 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 6.43 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 4.7 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 1.87 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.22 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 1.13 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 4.2 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.16 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 1.4 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.56 ' CE1' HG11 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 4.08 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 2.51 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 4.49 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.27 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.15 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 2.76 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 1.38 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 2.63 111.007 173.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.57 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 2.76 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 1.06 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 2.09 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 2.35 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.28 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 1.81 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 1.53 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 4.84 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 5.6 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 1.75 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 2.48 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 3.35 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 2.74 111.202 174.569 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 4.39 114.64 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.34 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.03 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 2.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 1.21 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 1.53 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 2.73 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 2.81 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.12 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.06 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 2.31 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 1.79 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 2.96 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 1.05 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.19 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 3.04 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 2.35 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 1.5 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 1.09 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 0.9 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 1.09 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 1.14 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 3.08 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.09 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 2.42 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 2.72 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 2.59 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 0.98 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.484 ' CG ' HG22 ' A' ' 571' ' ' ILE . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 2.18 111.139 169.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 3.25 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.39 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 2.73 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.484 HG22 ' CG ' ' A' ' 565' ' ' PHE . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 0.93 114.683 -163.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 1.5 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 7.21 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.75 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 4.25 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 2.95 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.08 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 4.61 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 3.49 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 1.74 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 3.16 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 2.51 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.13 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 4.35 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.01 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 0.88 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 0.94 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.37 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 599' ' ' MET . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 2.96 108.616 -137.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 2.17 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.07 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 3.96 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.43 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.561 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.561 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 4.17 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 591' ' ' VAL . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.36 113.075 -167.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.11 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 1.88 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.52 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.05 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 3.62 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 2.01 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.35 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 5.7 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.04 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.439 HD21 ' CG ' ' A' ' 638' ' ' PHE . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 2.51 113.103 -162.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 3.9 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 3.79 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 12.23 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 3.5 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 3.46 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.09 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 5.38 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 2.23 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.03 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 1.41 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 4.68 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 0.98 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 1.3 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 4.07 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 2.79 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 4.36 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 1.08 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 6.8 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 1.62 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 1.53 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.421 ' HB ' HD22 ' A' ' 612' ' ' LEU . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 1.87 112.092 174.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.439 ' CG ' HD21 ' A' ' 612' ' ' LEU . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 2.66 111.98 163.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 1.2 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 2.74 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 2.19 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.64 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 2.81 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 1.79 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 5.71 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 5.91 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.01 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.12 111.644 179.878 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.07 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 537' ' ' LYS 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 6.79 113.887 167.295 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 2.51 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.459 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 1.29 110.703 173.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 1.82 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.38 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 1.95 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 2.87 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . 0.459 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 2.69 112.999 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 1.52 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 2.69 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.453 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 1.32 114.057 -170.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.25 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 1.87 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 1.86 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.453 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 1.73 111.691 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 1.74 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 1.17 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.12 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 560' ' ' LEU . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 1.47 114.06 -165.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 2.19 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 3.21 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 557' ' ' LEU . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 2.76 112.064 -167.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.03 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 2.74 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 0.95 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 2.15 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 2.59 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 1.14 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 1.57 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 7.83 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 2.69 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 3.02 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 1.84 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 3.97 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 4.94 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 2.58 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 2.99 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 2.67 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 605' ' ' SER . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 0.92 111.284 -161.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.6 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 3.99 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 0.95 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 0.99 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 0.98 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.54 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 3.46 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 1.97 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 3.37 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 6.39 117.7 -162.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 4.87 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.48 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 3.62 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 2.39 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 2.61 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 0.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 1.74 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.457 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.01 111.429 170.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 5.78 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 2.52 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 5.73 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 5.4 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.776 HD23 HG22 ' A' ' 635' ' ' VAL . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.01 112.946 -167.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . 0.665 ' H ' HD13 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 3.37 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 2.98 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 7.03 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.36 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 5.02 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 5.64 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.13 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 1.53 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 1.93 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 1.09 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 3.72 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 0.99 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 1.12 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 3.41 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 2.76 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 2.92 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.07 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 7.47 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.4 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 1.35 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 2.47 112.19 -174.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 2.4 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.15 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.01 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 2.3 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.48 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 1.74 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 1.72 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 4.56 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 5.38 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 1.72 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 2.16 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.53 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 2.56 112.137 174.987 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 112.583 0.586 . . . . 3.33 112.583 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 5.64 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 3.71 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 2.44 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 1.84 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.12 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.52 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.42 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.46 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 2.81 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 2.62 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 1.82 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . 0.482 ' ND2' ' H ' ' A' ' 547' ' ' ASN . 5.1 p30 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 4.68 113.705 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 1.27 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.28 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 2.26 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 2.34 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 1.91 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 1.32 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 0.77 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . 0.549 ' HB3' HG11 ' A' ' 641' ' ' VAL . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 1.77 115.459 174.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 1.57 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 1.88 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 2.62 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.408 HD13 ' HG ' ' A' ' 633' ' ' LEU . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 2.58 114.135 -159.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 1.97 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 2.82 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 2.67 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 0.83 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 2.15 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.21 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 2.78 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.412 HD11 HG13 ' A' ' 622' ' ' VAL . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 1.42 115.626 -167.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.56 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 10.42 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.62 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.71 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 3.77 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 2.49 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 1.94 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.1 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 3.43 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 1.83 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 2.38 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 2.52 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 605' ' ' SER . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 0.74 111.575 -164.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.8 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 2.43 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 1.1 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 1.01 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.68 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 3.05 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 1.61 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 2.49 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 4.5 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 3.86 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.403 ' H ' ' HE2' ' A' ' 597' ' ' LYS . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.39 112.125 177.047 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 2.12 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.06 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 1.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.62 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.496 ' HB2' HD12 ' A' ' 584' ' ' ILE . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.07 111.551 167.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 3.43 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 2.36 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 7.63 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 6.53 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.482 HD22 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 2.55 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 3.51 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.2 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 10.6 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 2.45 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 4.26 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 4.9 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 3.24 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 1.8 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.07 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 571' ' ' ILE . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.03 114.437 -172.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 4.74 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 0.97 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.14 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.575 ' CE1' HG11 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 3.89 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 2.42 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 4.72 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 0.77 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.14 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 1.79 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.408 ' HG ' HD13 ' A' ' 560' ' ' LEU . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 1.63 110.821 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.0 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.462 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 1.74 111.453 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . 0.577 ' O ' HG12 ' A' ' 641' ' ' VAL . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.482 ' CG ' HD22 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 2.75 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 637' ' ' ASN . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 1.39 113.23 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 2.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 2.34 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.52 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 1.65 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 1.6 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 4.45 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 4.34 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.1 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 2.65 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 3.76 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.57 112.241 -174.196 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 113.856 1.058 . . . . 3.35 113.856 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 4.79 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 4.64 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 2.96 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.414 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.41 110.383 169.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.03 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 3.91 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 2.55 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.74 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 2.68 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . 0.414 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 2.56 114.153 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 2.17 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 3.77 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 1.25 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.44 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 2.43 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 2.21 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 1.78 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 1.36 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 0.87 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 0.84 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 0.89 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 2.56 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 2.71 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.455 HD13 ' HG ' ' A' ' 633' ' ' LEU . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 2.28 111.512 -165.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 2.68 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 2.87 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 0.97 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 2.07 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 2.8 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 1.05 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 1.8 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 6.92 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.42 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 2.86 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 2.42 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.27 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 5.15 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 4.77 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.33 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 3.41 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 2.9 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' A' ' 605' ' ' SER . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 0.85 110.442 -168.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 2.38 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 0.89 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 0.89 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 0.68 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.26 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 3.16 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 2.1 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.28 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.14 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 3.97 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.578 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.578 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 4.33 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 1.92 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 2.06 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 1.12 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.51 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.54 ' HB2' HD12 ' A' ' 584' ' ' ILE . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.05 111.867 173.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 3.45 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 2.28 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . 0.428 HG22 HG22 ' A' ' 614' ' ' THR . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 5.54 110.996 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 5.18 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 2.23 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 4.84 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . 0.428 HG22 HG22 ' A' ' 610' ' ' ILE . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 3.21 109.441 173.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 7.85 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 2.46 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 5.78 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 7.27 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 4.84 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 2.21 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 2.78 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 1.13 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.02 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 0.97 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 0.95 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 2.65 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 2.23 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.1 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.01 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.07 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 1.77 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.455 ' HG ' HD13 ' A' ' 560' ' ' LEU . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 1.39 109.871 -174.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.25 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 2.09 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 2.67 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.32 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 2.18 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 2.37 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.32 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 1.52 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 1.6 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.08 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . 0.408 ' HA ' ' HG2' ' A' ' 653' ' ' GLU . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 5.7 112.939 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 1.82 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 2.64 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 650' ' ' ARG . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.4 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p . . . . . 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.07 110.5 171.613 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.55 113.932 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 5.75 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 5.66 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 2.87 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 1.33 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 1.83 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.03 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 1.87 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 2.53 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 2.93 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 2.04 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 3.71 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 2.0 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.43 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.19 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 2.27 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 2.35 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 1.6 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 1.07 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 1.05 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 1.18 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 1.89 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 2.48 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 2.74 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 1.9 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 2.77 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 1.33 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 2.16 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 0.98 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 2.52 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 1.4 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 1.51 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 7.85 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.07 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.02 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.29 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 5.9 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . 0.457 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 3.81 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 2.8 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . 0.457 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 3.68 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 3.19 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 605' ' ' SER . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 0.95 110.845 -159.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.79 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 2.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 0.98 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 1.1 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.42 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.11 111.187 173.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.37 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 3.13 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 3.67 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.04 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . 0.501 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 4.72 115.874 -162.046 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 4.58 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.25 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 3.59 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 2.43 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 2.67 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 1.1 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 1.59 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.2 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.04 112.084 165.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 3.69 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 2.23 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . 0.549 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . 0.549 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 6.13 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.13 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 2.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 4.02 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 2.89 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 6.68 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.2 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 4.41 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 6.19 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.08 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 1.78 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 2.47 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 0.96 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.21 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 0.99 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . 0.42 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 1.13 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 2.56 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 2.53 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 3.46 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 0.92 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 6.48 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 1.81 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 1.35 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.05 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 2.2 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 4.17 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.89 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 0.94 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 649' ' ' ARG . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 4.32 112.325 170.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 2.32 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.79 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 1.62 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 2.55 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . 0.403 ' HA ' HD21 ' A' ' 642' ' ' LEU . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 4.79 110.115 163.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 7.0 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 1.91 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 2.28 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.55 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 2.69 111.282 -178.665 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 CA--C 1.548 0.87 0 CA-C-O 119.316 -0.373 . . . . 6.81 111.871 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 4.53 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 6.7 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 2.56 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 1.76 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 2.57 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.25 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.06 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 3.12 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 2.89 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 4.31 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.32 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.41 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 553' ' ' VAL . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.13 113.495 -178.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 1.79 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 2.64 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 550' ' ' PRO . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 2.35 112.166 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 1.5 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 1.71 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.21 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 1.82 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 2.38 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 2.65 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.16 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 1.88 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 2.71 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 1.34 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 2.4 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.2 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.09 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.61 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 3.28 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 1.26 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . 0.442 HG12 HG13 ' A' ' 622' ' ' VAL . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 2.69 110.412 -164.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 11.97 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.32 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 4.09 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.37 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 6.34 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 3.32 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 1.89 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 4.25 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 2.58 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 1.22 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 3.74 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 1.88 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 1.85 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.39 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 3.54 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 2.34 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 2.87 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 4.62 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 3.85 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.8 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.02 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 2.79 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 2.48 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 1.85 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 1.72 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.36 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.18 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 5.48 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 2.9 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 6.73 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.44 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' A' ' 635' ' ' VAL . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 2.59 109.031 174.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 3.46 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 3.96 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 6.89 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 3.88 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 3.67 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 9.46 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 3.55 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 2.24 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.67 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . 0.442 HG13 HG12 ' A' ' 572' ' ' ILE . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 1.96 113.616 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 4.47 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 1.62 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.0 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 2.49 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 1.97 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 4.24 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 1.21 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 6.67 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 1.71 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 1.93 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.45 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.446 ' HB ' HD22 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 2.57 111.581 171.498 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.436 ' CG ' HD21 ' A' ' 612' ' ' LEU . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 3.16 111.668 170.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 1.56 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 2.57 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 2.54 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.77 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 1.8 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 2.8 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 4.62 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 6.99 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.82 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 3.25 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 4.79 111.881 174.182 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 112.864 0.69 . . . . 4.0 112.864 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 5.91 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 4.86 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.03 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 1.15 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 1.62 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.65 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 1.67 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 3.22 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 2.34 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 1.95 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 3.4 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.22 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.29 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.33 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 2.3 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 1.52 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 1.18 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 0.94 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.0 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 1.36 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.08 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 4.53 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 2.59 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 2.3 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 2.29 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 1.34 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 2.12 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.03 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 2.85 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 1.34 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 2.67 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 7.77 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.71 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 2.59 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 2.6 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 1.71 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.23 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 5.34 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.17 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 4.28 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 2.7 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.582 HD12 ' HB2' ' A' ' 605' ' ' SER . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 1.0 110.673 -162.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 3.78 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 4.71 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 0.87 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 0.78 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.37 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 2.82 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 2.37 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 2.94 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.37 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.12 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.557 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 4.38 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.17 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 2.48 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 0.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.46 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.582 ' HB2' HD12 ' A' ' 584' ' ' ILE . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.64 111.738 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 3.93 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 2.52 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 5.72 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.33 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.591 HD23 ' HB ' ' A' ' 635' ' ' VAL 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 3.24 114.224 -164.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 4.98 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.68 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.0 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.24 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 3.53 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 5.44 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 3.38 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 2.0 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 2.34 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 1.38 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 3.75 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 0.82 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 0.86 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG11 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 3.23 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 2.54 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 5.62 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 0.94 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.57 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 2.07 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 1.66 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.43 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.591 ' HB ' HD23 ' A' ' 612' ' ' LEU . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 2.41 111.607 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.414 ' CD1' HD22 ' A' ' 612' ' ' LEU . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 2.28 111.603 172.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.07 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 2.09 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 2.11 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.09 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 2.55 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 2.29 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.05 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 7.14 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 2.16 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 2.61 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.48 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 3.4 111.176 171.003 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.6 118.991 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.32 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.01 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 2.54 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.03 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 1.4 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 2.57 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.75 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 2.75 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 2.09 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 1.76 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 2.88 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.23 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.43 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 2.43 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 2.3 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 1.57 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 1.09 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 1.07 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 0.96 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 0.95 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 2.55 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 2.87 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 560' ' ' LEU . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.04 113.74 -151.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 2.28 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 2.63 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 0.9 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.422 ' CG ' HG22 ' A' ' 571' ' ' ILE . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 2.09 111.583 165.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.61 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.42 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 2.97 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.422 HG22 ' CG ' ' A' ' 565' ' ' PHE . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 1.64 114.658 -169.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 1.95 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 8.83 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 3.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.16 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.62 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 4.42 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 4.28 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.18 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 2.65 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 2.84 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 605' ' ' SER . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 0.71 110.92 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 2.81 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 1.04 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 0.92 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.41 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 3.13 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 1.93 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 2.66 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 4.57 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 5.55 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 2.47 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 2.33 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 0.97 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 1.7 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.43 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.462 ' HB2' HD12 ' A' ' 584' ' ' ILE . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.11 111.204 164.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 3.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 2.29 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 6.7 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 6.84 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 2.35 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 4.65 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 2.74 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 7.49 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.04 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 3.56 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 8.13 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.19 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 2.04 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 1.98 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 1.35 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.12 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 0.95 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 1.38 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 2.49 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 2.32 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.13 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 0.74 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.08 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 2.61 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 1.5 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 2.98 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 2.58 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 2.54 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 1.39 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 642' ' ' LEU . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 1.93 114.722 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 2.59 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.6 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 2.14 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 1.6 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 3.99 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 5.47 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 1.62 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 2.43 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.45 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 3.6 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 2.89 111.754 -178.518 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.73 116.366 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 4.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 4.43 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 2.4 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 1.75 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.25 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 3.65 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.27 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 3.55 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.0 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 2.53 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 2.02 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.21 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 1.25 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.06 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 1.8 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 1.92 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 1.44 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 0.81 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 0.71 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 0.75 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 0.85 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 1.63 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 2.81 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.436 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 1.98 113.401 -166.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 2.36 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 2.18 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' A' ' 629' ' ' ARG . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.01 111.985 175.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.417 ' CG ' HG22 ' A' ' 571' ' ' ILE . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 2.14 111.777 168.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.27 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 3.68 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.417 HG22 ' CG ' ' A' ' 565' ' ' PHE . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 1.17 112.869 -175.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 2.52 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 8.29 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 2.96 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 3.07 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 4.34 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 582' ' ' TYR . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 4.93 113.519 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.39 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . 0.417 ' CE2' ' HE3' ' A' ' 580' ' ' LYS . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 2.75 111.78 -174.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 2.82 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.497 HD12 ' HB2' ' A' ' 605' ' ' SER . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.0 111.77 -165.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 3.58 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 0.99 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 0.93 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 0.72 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.61 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 3.29 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 1.8 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 2.96 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 5.58 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 4.95 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.496 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 4.29 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 2.35 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 2.15 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 1.07 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 1.6 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.497 ' HB2' HD12 ' A' ' 584' ' ' ILE . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.17 111.325 167.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 8.64 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . 0.411 ' CZ ' HD11 ' A' ' 584' ' ' ILE . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 2.5 115.476 -173.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . 0.483 HG21 HG23 ' A' ' 614' ' ' THR . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 6.52 114.386 168.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.63 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.761 HD23 HG22 ' A' ' 635' ' ' VAL . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.08 114.578 -169.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 3.57 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 610' ' ' ILE . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 2.88 112.859 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 7.64 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 2.68 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.03 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 6.81 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 3.6 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 1.87 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 2.17 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 1.32 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.37 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.06 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.27 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 3.2 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 2.5 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 564' ' ' VAL . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.12 108.382 169.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 0.98 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 7.71 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 1.45 108.836 -171.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.761 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 2.58 111.984 -176.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 2.57 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 0.9 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 1.96 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 1.95 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.14 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.04 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 1.91 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 6.58 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 4.7 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 1.75 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 2.94 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.79 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 2.91 112.133 177.149 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.543 0.942 . . . . 4.03 113.543 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 5.81 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 4.56 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 2.7 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . 0.408 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.0 111.405 176.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.4 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 2.72 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.01 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 3.5 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . 0.408 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 2.27 112.061 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 1.8 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.08 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 1.28 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.8 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 3.39 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 2.16 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 2.85 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 1.15 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 0.86 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 0.77 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 0.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 2.22 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 2.99 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 2.43 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 1.83 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 2.35 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 0.96 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 2.35 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.48 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.08 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 2.64 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 1.13 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 622' ' ' VAL . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 2.54 111.8 -168.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 10.62 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.3 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 4.32 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 4.23 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 5.88 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 4.28 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 1.82 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 3.19 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 2.46 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.464 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 0.77 110.761 -165.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 3.77 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.83 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' A' ' 626' ' ' THR . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 0.86 109.033 176.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.433 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 0.75 110.818 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 2.56 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 2.34 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.07 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.33 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 6.62 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 2.77 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 1.95 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 1.13 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.54 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.06 114.129 177.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 6.75 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 2.31 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 7.59 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 6.26 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 2.24 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 5.18 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 4.56 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 6.98 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.1 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 6.87 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 5.75 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 4.65 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 1.94 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.19 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . 0.426 HG13 ' CG1' ' A' ' 572' ' ' ILE . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 0.91 115.625 -178.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 4.95 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 0.74 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . 0.433 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . 0.406 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 0.86 110.186 -167.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 2.97 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.24 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.01 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 0.82 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.37 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 2.45 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 1.54 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 1.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.4 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 2.88 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.09 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 2.31 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 2.15 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.15 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 1.97 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 1.88 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.08 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 7.97 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.25 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 3.21 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.46 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.45 110.851 177.439 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 3.3 116.471 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 4.67 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 4.57 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 2.48 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 1.88 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.13 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.6 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 2.98 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 2.88 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 2.74 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 2.45 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.14 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 2.84 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 1.14 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.21 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 1.94 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 2.09 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 2.83 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.06 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 0.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 0.95 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 1.09 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 1.92 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 4.89 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 561' ' ' LYS . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 2.28 110.056 -173.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . 0.512 ' N ' HD23 ' A' ' 560' ' ' LEU . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.13 111.937 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 3.4 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 1.24 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . 0.413 ' CG ' HG22 ' A' ' 571' ' ' ILE . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 2.06 111.666 168.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.65 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.24 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 2.78 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . 0.413 HG22 ' CG ' ' A' ' 565' ' ' PHE . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 0.93 115.409 -160.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 1.48 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 7.41 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.56 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 2.86 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 2.58 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.74 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 4.72 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.17 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 1.95 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 2.49 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 2.75 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 1.48 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.1 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 2.75 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.23 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 0.99 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 0.72 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.25 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 599' ' ' MET . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 2.59 107.812 -141.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 1.78 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 2.6 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 5.37 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.49 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 4.66 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . 0.508 ' O ' HG12 ' A' ' 591' ' ' VAL . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 2.84 110.33 162.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 2.43 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 1.19 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.51 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.8 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.64 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.01 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 2.19 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.14 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 6.31 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.795 HD23 HG22 ' A' ' 635' ' ' VAL . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 1.95 114.574 167.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.06 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.17 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 6.57 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.58 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.1 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 5.62 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 3.33 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.05 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 2.77 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.01 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 4.58 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 0.92 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.14 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 4.0 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 2.81 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 3.67 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 1.35 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.05 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.52 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 3.07 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.44 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . 0.795 HG22 HD23 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 2.8 109.584 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 2.58 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.448 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 2.64 109.447 168.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 0.93 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 2.29 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 2.25 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.36 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 2.31 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 1.66 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.16 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 6.97 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 1.79 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 2.34 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.63 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 3.61 111.945 -175.172 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 4.83 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 3.75 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 2.13 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 1.38 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.19 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.51 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.68 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 2.8 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 2.26 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 1.67 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 1.41 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.57 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 1.96 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 1.43 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 1.04 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 0.8 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . 0.553 ' HG3' HG11 ' A' ' 641' ' ' VAL . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 1.56 114.512 171.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 0.86 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 2.02 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 2.55 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 633' ' ' LEU . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 2.21 112.311 -157.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 3.4 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 3.05 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.438 HG11 ' CE1' ' A' ' 627' ' ' TYR . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 1.16 111.776 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 1.92 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.53 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 4.02 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 1.16 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 1.73 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 7.15 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.59 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 2.94 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.21 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.05 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 4.93 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 6.63 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 2.31 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 5.46 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 2.68 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.583 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 1.2 111.458 -170.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 2.54 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.14 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 1.02 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 0.86 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.08 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.02 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 2.46 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.23 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 4.87 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 4.99 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 3.34 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.03 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 2.26 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 1.26 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 2.52 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.583 ' HB2' HD12 ' A' ' 584' ' ' ILE . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 3.81 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 2.21 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 8.44 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 6.14 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 2.21 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 4.44 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 4.42 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.12 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.48 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 4.45 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 7.05 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 3.99 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 1.9 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 2.76 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.11 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 5.12 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.17 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 1.29 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.438 ' CE1' HG11 ' A' ' 564' ' ' VAL . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 2.66 108.577 170.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 2.75 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.26 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 1.33 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.55 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 1.79 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.492 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 1.36 111.062 -177.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.28 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 1.9 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . 0.686 ' O ' HG12 ' A' ' 641' ' ' VAL . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.18 112.775 174.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 2.78 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 637' ' ' ASN . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 1.23 112.633 -172.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 2.24 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 2.07 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.43 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.26 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 2.26 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 6.49 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 6.69 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 1.65 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 2.61 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.7 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 3.05 111.02 175.027 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.084 0.772 . . . . 3.39 113.084 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 4.4 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 3.96 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 3.18 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 1.21 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 1.47 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.12 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.09 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.26 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 2.67 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 2.16 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 1.8 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 1.1 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.04 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 1.84 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 1.86 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 1.37 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 0.93 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.02 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 1.42 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 1.32 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.51 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 5.04 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 2.63 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 1.99 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 2.55 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 0.94 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 2.04 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.32 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 2.66 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 1.21 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.04 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 8.59 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.23 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 2.18 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.48 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 3.99 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 3.63 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 1.99 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 2.6 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 3.6 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.52 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.19 110.287 -161.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 2.66 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 0.92 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . 0.437 ' H ' ' CG2' ' A' ' 626' ' ' THR . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 0.99 108.117 171.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 0.71 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.1 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 2.9 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 1.63 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.51 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 6.39 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 3.8 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.69 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . 0.421 ' H ' ' CD ' ' A' ' 597' ' ' LYS . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 6.34 116.306 -168.685 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 1.73 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 2.36 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 1.66 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.54 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.42 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 584' ' ' ILE . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.18 111.852 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 4.06 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 2.76 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 2.66 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . 0.44 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.18 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 7.38 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 3.75 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 3.74 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.12 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 10.03 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.26 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 3.84 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 7.39 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 3.43 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 1.97 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 1.85 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 0.95 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 3.97 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 1.04 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . 0.437 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 1.48 109.306 -175.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 3.66 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 2.37 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 3.25 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 0.8 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.03 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 1.71 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 1.43 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.5 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 2.66 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 2.53 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.17 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 1.12 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 1.86 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 2.41 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 1.87 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 2.28 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 2.06 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 4.88 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 5.07 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.42 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 2.79 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 4.65 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.63 111.745 174.076 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 113.866 1.061 . . . . 3.63 113.866 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 4.46 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.0 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 2.43 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.12 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 1.57 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 2.77 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.59 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 3.49 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 2.28 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 1.7 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 2.99 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 1.35 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.22 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.32 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 2.19 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 1.57 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.08 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 0.77 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 0.92 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 1.06 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.02 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' LYS . . . . . 0.423 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 2.43 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.421 HD13 ' HG ' ' A' ' 633' ' ' LEU . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 2.3 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' LYS . . . . . 0.412 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.24 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 2.51 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' VAL . . . . . 0.529 HG11 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 0.92 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 2.66 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 2.76 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.17 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 1.89 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 7.47 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 2.97 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 2.47 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 1.75 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 579' ' ' LYS . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 4.4 113.056 -167.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.28 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 2.23 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 3.03 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 2.48 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' ILE . . . . . 0.449 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.29 109.627 -172.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 3.2 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.27 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 1.34 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.09 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.39 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.03 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 2.37 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.04 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 594' ' ' LYS . . . . . 0.532 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 5.93 115.87 -161.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.74 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.14 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.28 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 2.38 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 1.56 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 1.76 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.65 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 605' ' ' SER . . . . . 0.449 ' HB2' HD12 ' A' ' 584' ' ' ILE . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.32 110.583 160.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 3.82 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 2.71 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 7.47 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 612' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 638' ' ' PHE . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 3.05 112.898 -164.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 6.67 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 4.32 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 8.2 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.09 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 6.53 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 2.98 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 1.47 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 1.81 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 0.99 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 3.48 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.14 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.34 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 627' ' ' TYR . . . . . 0.529 ' CE1' HG11 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 3.25 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 2.61 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 4.62 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 1.16 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.32 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 2.34 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.421 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 2.56 112.02 -178.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.64 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 1.77 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 638' ' ' PHE . . . . . 0.41 ' CE1' HD11 ' A' ' 612' ' ' LEU . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 2.93 111.438 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 1.05 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 2.58 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 2.25 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.65 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 1.66 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 1.97 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 4.3 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 5.44 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.16 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 2.76 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.49 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 3.42 111.706 173.394 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.344 1.238 . . . . 8.86 114.344 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 97.2 m -73.42 38.6 0.09 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.647 2.379 . . . . 3.82 116.017 -170.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.2 -53.87 24.93 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 126.64 1.976 . . . . 6.48 112.89 -178.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -76.47 -24.76 53.84 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.722 1.209 . . . . 4.32 113.057 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 11.6 tp -81.07 -40.23 24.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.686 1.13 . . . . 3.78 112.175 -169.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.51 -36.01 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 118.0 0.364 . . . . 1.55 110.165 168.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.84 -9.93 56.6 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.067 1.136 . . . . 2.5 114.067 173.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 58.6 m -80.02 -14.92 58.19 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.875 -1.14 . . . . 3.85 111.723 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.72 137.44 94.99 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 126.616 1.966 . . . . 2.49 110.208 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.58 -22.91 37.5 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.827 1.685 . . . . 3.49 113.913 -171.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -73.91 -29.51 62.09 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.285 1.034 . . . . 3.16 112.482 173.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -81.57 -3.59 53.73 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.04 0.936 . . . . 2.39 112.668 -174.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . 0.25 . . -51.84 -29.75 20.72 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.21 2.204 . . . . 3.26 114.223 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -118.54 5.44 11.69 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 128.432 2.693 . . . . 3.97 111.459 -169.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -71.87 155.28 40.57 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.851 1.426 . . . . 1.87 114.851 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -72.24 122.19 86.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.882 1.273 . . . . 2.9 110.53 167.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -59.44 -15.23 28.98 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 125.067 3.845 . . . . 1.25 115.065 -173.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -85.85 -40.17 16.26 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.187 -0.945 . . . . 3.22 110.783 176.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -60.39 -49.63 76.82 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.521 1.129 . . . . 2.8 111.128 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.4 m -62.03 -32.53 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.287 0.565 . . . . 1.49 111.922 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -80.94 -40.27 24.77 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.267 1.827 . . . . 1.17 112.855 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.92 -19.4 65.86 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.666 -0.646 . . . . 1.1 111.607 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 29.1 ttm -73.17 -25.68 60.89 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.122 1.369 . . . . 1.14 113.647 175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 46.9 mt -75.18 -17.65 60.34 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.104 1.15 . . . . 1.31 114.104 -168.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 52.8 p -61.01 -26.91 67.94 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 116.532 2.049 . . . . 1.85 116.532 -169.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -123.22 20.29 9.79 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.03 1.493 . . . . 2.61 115.03 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.21 158.44 17.05 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.199 -0.938 . . . . 2.71 112.638 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.92 144.47 51.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.185 1.394 . . . . 1.83 112.59 175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -103.9 142.26 34.72 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.626 1.97 . . . . 2.85 111.232 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -152.71 144.86 23.85 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.756 1.021 . . . . 4.92 113.756 171.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.443 HG11 ' CE1' ' A' ' 627' ' ' TYR . 43.5 t -106.62 145.32 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 125.648 1.579 . . . . 0.99 111.793 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -124.54 156.95 36.48 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.831 1.252 . . . . 2.31 110.657 168.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -103.55 163.77 16.76 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.782 1.633 . . . . 2.78 110.181 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -60.05 134.93 59.35 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.204 1.936 . . . . 1.47 114.376 -171.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 92.3 -10.01 75.08 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 126.296 1.903 . . . . 1.73 113.094 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -84.13 124.5 31.2 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.731 1.266 . . . . 2.02 112.091 -170.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -65.25 116.63 6.8 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.841 0.857 . . . . 3.18 111.418 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -86.72 -27.84 5.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.703 0.801 . . . . 1.24 112.439 -175.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 87.6 mt -143.17 119.84 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 125.915 1.686 . . . . 2.51 109.834 -173.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 147.24 30.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.978 2.111 . . . . 9.79 110.458 161.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -93.1 158.64 15.67 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 115.949 1.833 . . . . 5.86 115.949 -177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -175.54 -7.91 0.02 OUTLIER Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.146 1.832 . . . . 4.23 114.703 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 t -149.33 169.97 19.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.015 1.326 . . . . 3.28 112.213 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.77 129.1 43.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 124.119 0.967 . . . . 3.65 110.876 -166.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.69 26.26 9.27 Favored Glycine 0 CA--C 1.533 1.216 0 N-CA-C 115.494 0.958 . . . . 1.92 115.494 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttp -57.58 160.45 4.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.207 1.003 . . . . 4.47 112.201 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -82.47 172.19 13.29 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.75 2.02 . . . . 4.48 113.822 -168.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.2 ptm -87.65 150.83 23.4 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 116.449 -0.341 . . . . 3.24 111.335 159.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -138.76 141.84 38.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.207 1.003 . . . . 2.37 109.249 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 12.1 p90 -151.01 146.66 26.36 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.903 -1.123 . . . . 2.91 112.761 -170.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.419 HD11 ' CE2' ' A' ' 607' ' ' PHE . 9.3 mt -91.86 108.66 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 123.956 0.902 . . . . 1.01 111.885 -159.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -82.84 -40.75 19.9 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.571 -0.705 . . . . 2.95 112.284 -177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -161.74 118.59 2.15 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.031 1.333 . . . . 2.82 110.496 171.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 144.86 -170.22 26.43 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.957 -0.857 . . . . 0.88 110.957 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 57.7 t -134.59 150.24 30.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.169 1.388 . . . . 1.11 108.061 -178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.6 m -120.51 152.62 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.353 1.461 . . . . 1.07 110.645 169.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.2 m -115.25 124.8 52.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 106.876 -1.527 . . . . 1.4 106.876 167.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . 0.443 HG13 ' HB2' ' A' ' 599' ' ' MET . 2.7 p -143.1 152.53 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 C-N-CA 125.122 1.369 . . . . 2.5 107.743 -140.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -121.91 132.23 54.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.235 -0.888 . . . . 2.49 109.11 168.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.28 0.8 OUTLIER -95.09 125.2 39.58 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 118.619 -1.232 . . . . 3.47 111.987 154.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . 0.471 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -56.65 -35.91 68.93 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 125.615 1.566 . . . . 5.35 114.664 -169.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -69.84 -16.97 72.88 Favored Glycine 0 N--CA 1.469 0.893 0 C-N-CA 125.096 1.331 . . . . 5.78 114.928 173.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -140.99 -139.95 0.13 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.836 0.854 . . . . 5.19 110.286 -146.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.42 163.38 12.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.505 1.522 . . . . 5.45 114.018 -170.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -66.39 129.25 39.21 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.29 -1.323 . . . . 4.11 109.539 153.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . 0.443 ' HB2' HG13 ' A' ' 591' ' ' VAL . 32.9 mtm -122.81 176.15 6.14 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.858 1.663 . . . . 2.65 110.739 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.58 156.62 18.07 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 125.428 1.491 . . . . 2.84 112.759 140.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.11 147.05 50.53 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.109 1.763 . . . . 1.57 110.61 165.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.3 p -129.24 164.26 23.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.355 1.462 . . . . 1.83 113.931 -170.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -49.28 144.46 5.29 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.544 1.683 . . . . 1.83 115.544 -169.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 88.29 -21.98 21.99 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.465 1.507 . . . . 1.95 113.969 -168.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.404 ' HB2' HD12 ' A' ' 584' ' ' ILE . 67.7 m -68.86 167.97 14.5 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.832 1.253 . . . . 1.46 113.502 175.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -136.19 151.13 49.4 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.638 1.975 . . . . 6.15 110.691 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . 0.419 ' CE2' HD11 ' A' ' 584' ' ' ILE . 0.1 OUTLIER -152.73 176.98 11.19 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.661 1.184 . . . . 2.3 113.835 175.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 87.24 106.97 0.87 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 125.606 1.574 . . . . 3.49 109.847 -163.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -94.51 21.81 6.83 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.036 0.934 . . . . 6.5 113.195 -166.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.44 111.72 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 124.892 1.277 . . . . 7.84 108.462 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 52.2 t -67.87 134.2 50.46 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.522 -0.737 . . . . 5.73 109.581 167.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.764 HD23 HG22 ' A' ' 635' ' ' VAL . 2.6 mt -51.43 -30.76 20.54 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.664 1.585 . . . . 2.43 113.349 174.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.8 mp -98.71 1.27 45.97 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.182 1.793 . . . . 4.82 113.616 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -61.58 158.78 14.42 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.707 0.765 . . . . 4.81 112.413 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -113.27 146.46 39.33 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.703 1.601 . . . . 6.89 108.819 163.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.94 175.82 25.37 Favored Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.72 1.048 . . . . 3.32 115.72 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 16.9 ptt85 -71.36 161.82 30.43 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.795 1.638 . . . . 3.62 113.741 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -120.28 177.24 5.1 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.154 2.582 . . . . 5.63 110.98 -169.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 33.7 m -124.71 125.25 43.79 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.239 -0.913 . . . . 3.44 112.377 167.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -148.84 162.88 38.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.965 2.106 . . . . 2.17 110.434 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 8.7 t -146.46 114.19 6.44 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.89 0.876 . . . . 2.11 110.315 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.32 143.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.428 -0.795 . . . . 1.51 112.633 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.1 158.1 34.69 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.537 1.535 . . . . 4.87 112.963 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.07 124.12 21.28 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.997 0.919 . . . . 1.16 110.548 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -69.74 -29.97 67.47 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.28 -0.887 . . . . 2.26 111.06 174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 3.9 t -147.09 178.1 8.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.43 1.892 . . . . 1.01 108.526 -163.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.443 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.8 OUTLIER -65.25 98.76 0.34 Allowed 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 106.921 -1.511 . . . . 3.84 106.921 164.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 15.7 p -108.84 131.43 55.0 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.692 1.197 . . . . 1.96 111.233 -167.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.0 mmm-85 -90.52 110.11 21.24 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.604 1.962 . . . . 3.58 108.044 174.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 25.0 mt -115.67 167.11 11.21 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.667 1.187 . . . . 1.04 110.694 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -134.07 153.5 51.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 126.254 1.821 . . . . 8.24 109.647 176.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 22.7 t -147.29 150.93 35.74 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.908 1.077 . . . . 2.07 113.908 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.95 133.64 30.41 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 126.44 1.896 . . . . 2.33 108.566 172.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 7.6 p -61.72 135.47 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.713 0.768 . . . . 2.03 112.344 172.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.764 HG22 HD23 ' A' ' 612' ' ' LEU . 1.3 p -57.09 -38.98 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 121.853 0.835 . . . . 2.59 110.89 -174.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.038 -1.039 . . . . 2.83 112.46 -172.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -81.36 -18.45 45.57 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.83 1.252 . . . . 2.81 113.748 177.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.437 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -74.82 -41.32 60.13 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.719 1.607 . . . . 3.01 109.322 161.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 33.9 m-20 -60.28 -28.4 68.05 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 120.686 -1.259 . . . . 2.24 113.056 169.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -68.85 -47.71 65.3 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.573 1.079 . . . . 3.51 112.411 175.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 4.3 p -74.98 -28.08 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 124.125 0.97 . . . . 1.49 112.651 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.8 mt -52.08 -38.41 57.1 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.808 0.731 . . . . 2.61 112.864 170.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -66.96 -20.43 65.89 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.189 1.181 . . . . 4.32 114.189 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -74.92 -17.57 60.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.221 1.009 . . . . 2.32 113.143 172.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 58.9 m-85 -132.22 68.01 79.49 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 126.572 1.949 . . . . 2.51 110.608 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -55.29 -23.43 37.46 Favored 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 124.655 3.57 . . . . 2.49 115.549 -172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 40.4 ttp -59.32 -47.98 83.36 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.809 1.186 . . . . 2.84 111.219 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 67.6 mmm -69.74 -31.17 69.0 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.175 0.59 . . . . 2.51 111.31 176.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.6 tmm_? -61.16 -45.67 93.67 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 121.171 -0.955 . . . . 3.88 112.289 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 49.4 ptt85 -66.91 -36.42 82.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 113.471 0.915 . . . . 5.3 113.471 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.28 -20.27 41.17 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.336 1.054 . . . . 2.75 113.325 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -90.19 -34.88 15.66 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.568 1.547 . . . . 3.63 114.165 169.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -65.4 -13.96 59.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 120.608 -1.308 . . . . 3.69 113.586 176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 10.1 t -90.1 -51.49 5.43 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.664 1.186 . . . . 4.88 112.873 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -62.13 -26.05 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.204 1.802 . . . . 4.47 112.493 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -52.68 -12.36 0.29 Allowed 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 125.652 1.581 . . . . 4.04 114.817 166.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 13.5 tt -139.08 -27.67 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 114.639 1.348 . . . . 7.43 114.639 161.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -67.12 -18.5 65.33 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.404 -1.435 . . . . 5.15 114.772 -173.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 29.2 ptt-85 -71.61 -11.81 61.04 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 116.961 2.208 . . . . 7.08 116.961 -171.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.28 -50.57 64.59 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.206 1.187 . . . . 8.68 114.206 -162.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -99.69 10.9 40.53 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 114.455 1.28 . . . . 10.7 114.455 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -84.15 5.32 26.7 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.573 -1.33 . . . . 14.35 113.593 -174.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 1.7 mp -33.9 88.78 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 130.309 3.444 . . . . 16.94 117.205 -160.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 64.59 19.13 64.52 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 126.55 2.024 . . . . 21.2 114.881 165.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -73.81 150.22 41.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.547 1.174 . . . . 22.1 112.357 -172.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -103.15 151.68 22.31 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.882 1.273 . . . . 27.38 110.647 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.0 -51.08 69.49 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.532 0.733 . . . . 29.71 111.769 -176.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 44.1 p -125.46 -72.08 0.68 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.901 1.68 . . . . 31.83 110.912 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 24.1 pt -151.67 159.59 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 127.578 2.351 . . . . 37.34 110.625 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 35.3 tp -91.86 57.7 3.24 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.641 1.577 . . . . 36.79 110.382 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 47.8 tp -132.86 133.89 43.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.217 1.407 . . . . 41.63 111.401 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 . . . . . 0 C--O 1.256 1.41 0 C-N-CA 129.642 3.177 . . . . 45.17 116.166 -177.673 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 CA--C 1.554 1.115 0 N-CA-C 109.237 -0.653 . . . . 8.21 109.237 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.62 42.66 0.37 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.804 1.642 . . . . 4.08 114.661 -169.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -52.5 -31.55 35.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.052 1.341 . . . . 3.79 113.664 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -52.92 -32.95 48.29 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.432 1.493 . . . . 4.25 113.678 174.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.22 -47.99 13.79 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.613 0.765 . . . . 2.42 111.51 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.07 -39.0 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 121.785 -0.572 . . . . 1.11 111.042 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.08 -16.84 64.19 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.677 1.191 . . . . 1.43 114.15 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 32.9 m -92.0 -7.62 48.39 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.566 1.546 . . . . 2.79 113.635 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.07 131.33 92.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.377 1.471 . . . . 2.85 109.546 172.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.15 -18.38 64.73 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.46 2.773 . . . . 1.87 114.833 -174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.6 tt -74.77 -21.01 59.57 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.896 1.278 . . . . 2.41 113.222 173.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -97.1 12.98 30.76 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.222 2.609 . . . . 2.13 112.696 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.16 67.12 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.527 1.677 . . . . 1.6 115.527 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -118.13 20.36 13.23 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.158 2.183 . . . . 3.76 112.181 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.01 154.16 23.37 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.979 0.895 . . . . 0.98 113.213 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -87.83 131.31 43.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.531 1.132 . . . . 2.26 110.473 169.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -63.91 -16.36 54.37 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.275 2.65 . . . . 1.06 114.695 -172.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -90.57 -37.62 13.71 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.388 1.475 . . . . 1.8 109.655 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -61.08 -49.31 77.86 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.578 1.551 . . . . 1.83 111.746 172.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.0 m -64.19 -28.72 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.374 0.509 . . . . 1.34 112.374 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.5 m -80.3 -44.43 19.57 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 125.703 1.601 . . . . 0.97 112.854 177.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.61 -18.64 62.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.986 -1.071 . . . . 0.81 112.677 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.5 ttm -71.01 -16.52 62.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.371 1.869 . . . . 0.84 114.364 174.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 18.9 mt -94.37 -9.51 35.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.105 1.362 . . . . 0.94 114.519 -172.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.2 p -63.62 -20.35 65.61 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.706 2.113 . . . . 1.88 116.706 -163.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.85 13.98 9.25 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.593 1.557 . . . . 2.67 114.685 169.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 15.9 tp -61.8 151.63 33.73 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.358 1.463 . . . . 2.4 112.826 -165.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.96 146.09 43.22 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.955 1.302 . . . . 1.83 112.878 -174.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.5 149.25 42.71 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.672 1.189 . . . . 2.35 112.499 176.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -139.19 158.52 44.03 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.299 1.039 . . . . 3.53 112.158 -176.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.505 HG11 ' CE1' ' A' ' 627' ' ' TYR . 25.4 t -134.56 141.77 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.992 1.717 . . . . 0.71 111.598 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 571' ' ' ILE . 84.7 m-85 -122.94 140.69 52.73 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.044 1.337 . . . . 1.85 111.412 171.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -82.55 166.27 37.3 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.199 1.399 . . . . 2.96 111.021 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -58.05 128.74 29.98 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 122.562 2.175 . . . . 0.89 113.053 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.97 -11.84 65.85 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 126.52 2.01 . . . . 1.04 113.515 176.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -84.82 128.15 34.48 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.021 1.411 . . . . 1.86 113.141 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -59.63 123.29 16.43 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.227 1.011 . . . . 2.3 111.178 172.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.419 ' HA ' ' CE2' ' A' ' 565' ' ' PHE . 7.3 pt -89.87 -28.37 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 113.579 0.955 . . . . 0.87 113.579 -171.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 74.3 mt -133.56 143.7 38.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 126.052 1.741 . . . . 1.46 110.529 -171.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -137.51 166.09 24.71 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.523 1.529 . . . . 7.42 111.885 169.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -88.05 167.05 14.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.188 1.395 . . . . 5.34 110.1 169.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.66 -9.38 0.08 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 116.709 1.443 . . . . 4.29 116.709 158.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.4 t -166.16 160.95 16.68 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.712 1.756 . . . . 3.02 114.894 -166.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.03 160.95 4.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 126.67 1.988 . . . . 3.2 109.771 157.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.85 48.95 5.57 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 121.254 -0.904 . . . . 3.09 111.445 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -109.56 152.31 25.65 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.073 1.349 . . . . 4.24 112.876 -166.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 26.0 mtmm -96.26 162.99 13.27 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.301 1.44 . . . . 3.42 114.401 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 28.3 ttt -88.63 150.62 22.94 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.175 0.99 . . . . 1.96 110.214 159.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -136.6 146.47 46.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.18 0.992 . . . . 2.4 110.238 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -146.08 151.52 37.83 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.171 -0.956 . . . . 2.78 113.111 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.471 HD12 ' HB2' ' A' ' 605' ' ' SER . 13.1 mt -92.27 112.89 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.311 1.044 . . . . 0.81 110.336 -166.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.24 -45.58 9.43 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 122.914 0.486 . . . . 3.24 111.324 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -157.04 110.57 2.6 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.93 0.892 . . . . 2.99 111.647 176.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.09 -162.53 28.98 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.541 1.543 . . . . 0.75 110.888 171.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.7 t -139.92 142.7 31.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 C-N-CA 124.437 1.095 . . . . 0.76 109.192 -175.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.0 m -124.92 145.52 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.881 1.272 . . . . 0.66 110.342 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.5 m -110.55 128.26 55.57 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.722 1.609 . . . . 1.06 107.058 174.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 599' ' ' MET . 6.1 p -142.08 150.43 18.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.628 -1.249 . . . . 2.57 107.628 -142.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -129.95 127.16 39.51 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.01 -0.737 . . . . 1.54 109.01 175.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.4 p -91.23 129.93 37.16 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 114.619 1.34 . . . . 2.18 114.619 163.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 143.58 26.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.24 1.016 . . . . 4.0 111.692 171.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.66 -26.06 2.38 Favored Glycine 0 N--CA 1.469 0.876 0 N-CA-C 114.868 0.707 . . . . 3.58 114.868 -167.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.498 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 43.3 m-20 -133.37 -121.98 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.361 0.665 . . . . 3.53 109.915 -144.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.498 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.4 OUTLIER -102.78 173.51 6.29 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 114.098 1.147 . . . . 4.39 114.098 -148.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -114.58 123.35 49.12 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 112.676 -2.056 . . . . 4.84 108.768 153.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . 0.465 ' O ' HG12 ' A' ' 591' ' ' VAL . 35.2 mtm -128.38 174.12 9.6 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 127.04 2.136 . . . . 1.68 111.825 -169.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -104.28 159.86 15.36 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.473 1.909 . . . . 1.91 113.911 141.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.4 mp -128.8 148.75 50.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.292 2.237 . . . . 0.97 108.752 161.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 78.5 p -125.53 171.73 10.29 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.375 1.07 . . . . 1.65 112.938 -177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -51.38 139.81 18.69 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.295 0.85 . . . . 2.07 113.295 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.93 -12.52 67.25 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.982 1.277 . . . . 1.09 115.051 -166.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.471 ' HB2' HD12 ' A' ' 584' ' ' ILE . 18.5 m -80.27 165.16 22.62 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 118.706 1.253 . . . . 0.91 111.862 172.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -150.65 157.22 42.72 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.384 0.883 . . . . 3.55 113.384 -178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -157.68 -177.62 6.72 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 122.62 1.2 . . . . 2.3 113.881 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 90.75 -32.18 5.2 Favored Glycine 0 CA--C 1.535 1.34 0 C-N-CA 126.258 1.885 . . . . 3.3 116.04 172.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -142.14 153.41 44.07 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.223 1.512 . . . . 8.64 111.257 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.75 -42.0 6.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 126.391 1.876 . . . . 5.0 110.8 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.4 t -166.6 157.63 12.58 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.851 2.061 . . . . 7.26 110.715 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.433 HD11 ' CD1' ' A' ' 638' ' ' PHE . 91.0 mt -63.26 -13.63 40.36 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 119.981 -1.699 . . . . 3.24 113.155 169.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.04 5.67 18.83 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.524 1.93 . . . . 4.43 113.212 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.4 p -88.88 141.89 28.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.701 -0.852 . . . . 3.55 108.701 151.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -142.6 173.2 11.75 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.794 1.238 . . . . 6.38 112.141 -169.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 87.14 -160.94 32.51 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.55 0.595 . . . . 2.82 113.514 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 14.1 mmm-85 -58.72 133.41 55.91 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 4.1 111.448 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -132.89 142.12 48.75 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.808 2.043 . . . . 10.33 111.319 -176.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.8 m -148.39 142.07 25.56 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.125 0.97 . . . . 4.01 111.661 -153.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.99 138.5 12.8 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.081 0.952 . . . . 2.45 111.478 162.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.8 p -102.91 87.76 3.01 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.272 1.429 . . . . 3.33 110.95 -176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -154.06 148.15 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 N-CA-C 114.323 1.231 . . . . 0.89 114.323 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -133.53 159.43 40.44 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.407 1.883 . . . . 4.2 112.786 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -79.39 129.92 34.93 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.392 -0.818 . . . . 0.77 111.01 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -79.56 -12.72 59.84 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-O 122.413 1.101 . . . . 2.73 112.906 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 4.0 t -161.68 173.58 14.49 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.039 2.536 . . . . 0.97 108.456 -162.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.505 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.2 OUTLIER -70.31 105.35 2.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 107.79 -1.189 . . . . 3.17 107.79 175.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.8 t -115.6 132.21 56.7 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.188 1.395 . . . . 2.47 111.755 -169.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 11.6 mmt85 -92.68 119.66 32.31 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.434 1.894 . . . . 4.4 109.862 173.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 40.6 mt -110.06 167.7 9.98 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.961 1.705 . . . . 0.86 111.293 173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.53 140.98 50.48 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.616 1.567 . . . . 7.52 109.388 171.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 14.6 m -125.18 125.02 43.01 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.294 1.037 . . . . 2.22 111.457 -166.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -132.84 115.31 15.13 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.1 0.96 . . . . 1.5 111.104 -171.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.1 p -79.98 134.5 36.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.942 1.297 . . . . 2.16 113.1 178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.31 -23.86 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 O-C-N 121.322 -0.861 . . . . 1.86 112.697 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.18 -35.6 73.85 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.232 0.924 . . . . 2.72 113.118 173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -83.39 -33.74 25.7 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.011 0.924 . . . . 2.22 111.595 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.433 ' CD1' HD11 ' A' ' 612' ' ' LEU . 0.8 OUTLIER -63.89 -53.7 46.39 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.496 1.518 . . . . 2.54 111.871 175.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -60.81 -21.26 62.95 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.159 -1.588 . . . . 1.91 113.137 171.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -80.05 -39.79 29.06 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 126.359 1.863 . . . . 4.44 112.643 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 9.2 p -73.08 -26.73 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.98 0.912 . . . . 0.92 112.476 168.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 2.7 tp -51.67 -32.28 29.05 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.348 1.459 . . . . 2.97 114.423 168.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -67.76 -20.56 65.24 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -85.72 -18.74 32.24 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 120.548 1.522 . . . . 2.7 113.398 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -128.53 72.87 80.73 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 126.299 1.84 . . . . 2.19 110.908 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.09 -22.22 38.44 Favored 'Trans proline' 0 CA--C 1.538 0.709 0 C-N-CA 124.561 3.508 . . . . 1.66 116.862 -169.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -64.01 -35.04 79.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.379 1.445 . . . . 1.89 112.091 170.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.38 -27.15 62.19 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.267 1.027 . . . . 1.63 111.678 -169.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.92 -54.05 51.54 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.406 0.682 . . . . 5.59 110.588 168.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 61.0 ttt-85 -64.75 -40.79 95.89 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.219 1.008 . . . . 6.66 112.874 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -55.86 -26.92 49.26 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.938 1.695 . . . . 2.06 113.284 173.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.6 m-30 -91.57 -36.62 13.59 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.039 1.335 . . . . 2.76 112.821 173.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -53.08 -38.48 62.56 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.379 1.072 . . . . 4.64 112.751 174.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 6.4 t -85.78 -14.01 46.46 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.49 1.916 . . . . 4.06 114.701 -171.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 4.6 p -102.55 -37.43 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 125.872 1.669 . . . . 4.19 111.755 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -51.86 -41.78 62.13 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.207 1.003 . . . . 5.41 113.17 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -64.98 -10.94 10.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 114.931 1.456 . . . . 7.43 114.931 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -117.9 -36.45 3.63 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.587 1.555 . . . . 7.49 112.092 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -66.07 -18.2 65.19 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.36 1.464 . . . . 7.99 113.592 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 35.8 tp -47.38 -33.7 6.22 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.54 2.336 . . . . 7.99 115.386 171.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -50.01 142.65 9.01 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.368 1.618 . . . . 11.33 115.368 -171.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 67.7 mtt85 -62.58 -3.15 1.32 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.985 2.514 . . . . 15.65 117.197 -163.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 10.8 mm -71.8 99.76 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 123.605 1.669 . . . . 17.77 113.447 -157.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 59.83 23.23 58.69 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 127.117 2.294 . . . . 21.65 113.037 -169.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -140.54 147.15 39.06 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.301 1.44 . . . . 19.97 113.853 -161.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 5.9 tmtt? -67.66 155.75 38.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.848 1.259 . . . . 24.95 110.517 172.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -129.19 173.12 10.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.76 1.624 . . . . 21.78 112.704 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.8 m -146.88 -173.54 4.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.718 1.607 . . . . 22.63 112.533 -175.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 20.2 pt -66.15 150.93 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.701 2.001 . . . . 24.88 112.848 172.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -105.92 166.06 10.75 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.636 1.347 . . . . 22.79 114.636 -172.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 51.2 tp -84.02 145.92 28.24 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.545 1.313 . . . . 25.42 114.545 -175.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 52.6 t60 . . . . . 0 C--O 1.254 1.339 0 C-N-CA 131.022 3.729 . . . . 29.77 115.733 169.178 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 110.468 -0.197 . . . . 7.73 110.468 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 3.7 m -65.59 145.61 55.86 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 120.78 0.324 . . . . 6.81 110.911 170.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -40.67 93.73 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.613 0.765 . . . . 7.6 109.916 174.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -53.75 -27.03 26.21 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.109 1.764 . . . . 7.26 114.357 168.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 10.5 tp -79.73 -43.04 23.35 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.077 0.853 . . . . 2.23 111.754 -174.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -47.63 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 109.291 -0.633 . . . . 1.73 109.291 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.55 4.87 2.11 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 115.769 1.766 . . . . 2.01 115.769 -175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.5 m -81.66 -10.02 59.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.949 1.25 . . . . 2.45 112.316 -177.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.0 mtp -72.72 144.34 85.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.952 0.901 . . . . 2.45 111.967 170.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -52.99 -32.4 57.66 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.41 2.74 . . . . 2.07 114.356 169.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . 0.301 0.2 OUTLIER -68.37 -11.76 60.08 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.636 1.347 . . . . 2.41 114.636 -178.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -109.63 12.22 24.36 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.024 1.73 . . . . 2.37 112.874 173.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -48.88 -32.43 8.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.995 1.718 . . . . 1.94 114.344 -177.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -122.66 10.26 9.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 127.423 2.289 . . . . 2.75 111.065 -168.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.46 147.13 46.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.225 1.41 . . . . 1.06 113.716 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -81.27 136.98 49.13 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 124.188 0.995 . . . . 2.22 110.492 166.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' A' ' 553' ' ' VAL . 46.3 Cg_endo -62.15 -26.61 78.01 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.574 2.849 . . . . 1.35 113.962 -177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -76.71 -40.41 48.8 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 120.501 -1.374 . . . . 1.88 110.966 177.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -60.89 -53.35 58.4 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.677 1.591 . . . . 2.59 111.024 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 550' ' ' PRO . 8.6 p -66.4 -26.97 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.527 0.731 . . . . 2.59 112.498 -177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 98.7 m -80.84 -43.49 19.91 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.997 1.319 . . . . 0.95 113.085 176.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.46 60.73 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 121.29 -0.882 . . . . 0.74 112.355 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.3 ttm -63.19 -26.81 68.97 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.667 2.387 . . . . 1.15 114.792 171.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.98 -8.02 44.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.988 1.715 . . . . 0.99 114.131 -167.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 61.4 p -69.53 -16.46 63.44 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.862 2.171 . . . . 1.87 116.862 -156.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.96 15.05 9.25 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 115.046 1.498 . . . . 2.54 115.046 171.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.51 HD12 ' H ' ' A' ' 561' ' ' LYS . 30.6 tp -52.3 151.59 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.526 2.731 . . . . 2.17 115.23 -163.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . 0.51 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.1 OUTLIER -113.22 145.69 40.57 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 126.591 1.956 . . . . 2.01 113.37 -175.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -134.04 142.12 47.47 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.062 1.745 . . . . 2.32 110.746 -164.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -147.47 153.16 39.2 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.306 1.042 . . . . 2.79 112.46 177.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 55.6 t -122.18 148.2 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.32 1.448 . . . . 0.79 111.267 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -128.25 142.52 51.13 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.667 1.187 . . . . 2.43 110.9 167.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 54.5 mm-40 -85.65 159.62 54.95 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.517 1.527 . . . . 3.19 111.285 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -52.41 135.47 54.42 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.384 2.723 . . . . 1.19 113.646 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 81.04 -1.05 86.23 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 124.232 0.92 . . . . 1.5 113.038 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -83.19 129.45 35.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.935 0.874 . . . . 2.22 111.447 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -69.62 109.39 4.29 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 123.744 0.818 . . . . 3.44 109.113 173.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.427 HD12 ' CZ ' ' A' ' 607' ' ' PHE . 10.0 pt -83.31 -25.02 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 N-CA-C 112.737 0.643 . . . . 1.57 112.737 -173.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 35.0 mm -97.33 138.63 21.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 125.127 1.371 . . . . 2.8 111.705 -170.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.27 140.61 49.98 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 114.412 -1.267 . . . . 9.24 110.966 144.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -98.89 162.68 12.95 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.387 1.475 . . . . 4.69 111.026 163.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.34 -12.94 0.35 Allowed Glycine 0 C--N 1.342 0.911 0 CA-C-O 117.553 -1.693 . . . . 4.13 117.136 169.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.0 t -150.0 159.43 44.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.223 2.011 . . . . 2.55 115.584 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 7.6 mt -81.76 157.71 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 128.426 2.69 . . . . 2.49 111.484 168.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.3 33.9 13.36 Favored Glycine 0 N--CA 1.468 0.784 0 C-N-CA 124.195 0.902 . . . . 1.88 111.197 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 52.8 tttt -89.29 138.09 31.74 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.026 1.331 . . . . 4.83 110.833 -168.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -97.25 -179.84 4.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.525 1.53 . . . . 6.12 111.619 -171.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 77.6 mmm -82.58 136.71 34.75 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 122.273 -0.267 . . . . 2.37 110.991 175.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -126.77 125.16 41.28 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 107.438 -1.319 . . . . 2.71 107.438 162.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -147.45 154.79 41.24 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.665 -0.647 . . . . 3.45 111.607 -170.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 34.4 mt -93.5 103.82 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 109.639 -0.504 . . . . 1.03 109.639 -155.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -55.14 16.57 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.826 0.739 . . . . 3.5 110.4 177.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 62.8 t-80 -150.07 121.35 7.84 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.815 0.672 . . . . 2.27 112.815 172.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 145.15 -163.09 28.14 Favored Glycine 0 CA--C 1.526 0.752 0 C-N-CA 124.738 1.161 . . . . 1.2 110.906 174.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 67.7 t -139.61 149.04 22.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.991 1.316 . . . . 1.38 109.575 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.4 m -128.94 145.18 36.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.474 1.509 . . . . 0.95 110.041 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 54.8 m -109.43 127.7 54.58 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.311 1.444 . . . . 1.3 107.913 176.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.6 p -145.25 154.7 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-N 113.382 -1.735 . . . . 2.6 108.387 -139.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.93 137.99 51.34 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.806 -1.088 . . . . 2.2 108.437 159.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.1 p -93.26 132.23 37.65 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 119.784 -0.766 . . . . 2.8 110.147 153.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.76 -34.87 78.85 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.151 1.537 . . . . 4.23 115.151 -159.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.6 -6.82 88.88 Favored Glycine 0 N--CA 1.471 1.019 0 CA-C-N 119.049 0.84 . . . . 4.76 113.979 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 -141.66 -149.08 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.522 0.729 . . . . 4.44 110.106 -141.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.75 167.15 9.97 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 125.876 1.67 . . . . 4.78 115.182 -164.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -66.44 116.47 7.46 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 114.114 -1.403 . . . . 4.03 111.186 162.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.9 mtm -118.68 174.02 6.52 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 124.83 1.252 . . . . 2.27 112.946 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -101.85 151.71 21.76 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.809 1.643 . . . . 2.19 112.888 138.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 3.2 mp -116.19 148.14 40.69 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.147 1.779 . . . . 1.51 109.488 162.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 60.7 p -124.46 176.72 6.31 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.575 1.55 . . . . 2.47 113.204 -165.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -57.54 127.38 31.74 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.166 -1.584 . . . . 3.11 112.24 177.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.93 3.41 79.94 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.061 1.315 . . . . 1.62 115.812 -167.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 73.0 m -88.2 167.19 13.81 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.813 1.245 . . . . 1.36 111.963 170.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -145.49 151.19 37.8 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 115.234 1.568 . . . . 3.93 115.234 -173.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . 0.427 ' CZ ' HD12 ' A' ' 571' ' ' ILE . 13.5 p90 -149.17 -172.5 4.14 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 128.407 2.683 . . . . 3.13 110.36 176.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 108.87 -95.17 0.89 Allowed Glycine 0 N--CA 1.464 0.531 0 N-CA-C 109.398 -1.481 . . . . 4.02 109.398 -170.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.18 159.73 43.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.407 1.483 . . . . 5.77 109.813 165.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.66 129.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 105.663 -1.977 . . . . 5.33 105.663 154.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 19.3 p -149.79 -161.64 1.39 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.819 1.248 . . . . 5.47 110.998 -166.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 71.99 -55.11 0.67 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 127.996 2.518 . . . . 3.21 114.064 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.25 -3.98 36.23 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.233 1.413 . . . . 3.83 113.262 165.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 35.2 p -132.28 161.61 33.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.089 1.756 . . . . 3.34 113.288 178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -144.2 151.74 39.9 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.717 2.007 . . . . 8.05 111.312 161.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 170.45 176.47 39.92 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 124.551 1.072 . . . . 2.1 113.73 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 38.0 mmm-85 -88.02 156.95 19.05 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.178 1.391 . . . . 5.37 111.124 169.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 26.7 ttt85 -127.49 171.14 11.84 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.028 1.331 . . . . 7.39 111.321 176.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 20.1 p -111.81 130.12 55.92 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.757 1.223 . . . . 4.07 108.305 150.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -141.96 125.74 17.02 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.791 -0.568 . . . . 2.35 112.514 -170.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 15.1 m -143.89 94.92 2.65 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.122 1.369 . . . . 1.97 110.176 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.5 p -153.74 145.19 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.414 -0.804 . . . . 0.88 112.586 175.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.36 161.82 33.49 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.825 2.05 . . . . 5.16 112.336 178.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.08 128.25 35.3 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.326 -0.859 . . . . 0.82 112.434 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -76.85 -19.91 56.94 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.32 1.057 . . . . 2.85 112.328 175.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -170.38 172.28 6.19 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.11 2.164 . . . . 1.11 108.374 -158.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.25 115.37 4.96 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.934 -1.104 . . . . 3.0 109.099 170.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.8 t -131.07 125.0 32.03 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.638 1.175 . . . . 2.21 110.497 -162.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -99.88 114.72 28.12 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 125.367 1.467 . . . . 2.92 109.347 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.6 mt -105.06 157.45 17.23 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 125.418 1.487 . . . . 1.13 110.296 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -132.46 152.43 51.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.363 -0.835 . . . . 6.01 110.646 171.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 15.8 t -134.32 109.04 8.55 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.836 0.827 . . . . 2.69 109.994 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.6 tt -98.4 104.12 16.12 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 106.236 -1.764 . . . . 1.48 106.236 174.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 33.2 t -67.14 150.01 49.73 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.11 0.481 . . . . 2.13 111.07 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.5 m -51.1 -33.34 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.84 0.456 . . . . 2.55 111.44 170.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -55.1 -27.77 47.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.096 1.758 . . . . 2.86 114.658 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -97.2 -20.8 17.69 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.447 1.099 . . . . 2.52 113.836 176.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -90.96 -46.33 8.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.211 2.604 . . . . 2.63 110.951 -171.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 32.4 p30 -70.99 -16.81 62.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.343 -1.473 . . . . 4.63 114.429 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -63.07 -50.61 69.92 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.131 0.973 . . . . 3.3 112.399 162.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -85.77 -22.56 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.115 0.966 . . . . 1.57 113.378 -165.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 11.3 mt -41.34 -42.11 2.13 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.789 0.836 . . . . 2.2 112.338 158.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.2 -12.32 38.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 4.41 113.175 -175.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -76.38 -17.62 59.28 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.564 1.529 . . . . 2.65 112.433 173.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -133.47 64.31 68.27 Favored Pre-proline 0 CA--C 1.536 0.413 0 C-N-CA 127.787 2.435 . . . . 2.7 107.054 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.62 -8.6 7.53 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 124.365 3.377 . . . . 1.46 116.843 -158.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.0 ptt? -62.25 -32.64 73.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 120.186 1.357 . . . . 1.69 111.246 165.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.18 -35.36 61.57 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 126.247 1.819 . . . . 2.04 111.322 -177.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -54.54 -54.98 34.06 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.742 -0.647 . . . . 6.42 110.22 164.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -56.63 -41.1 76.55 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.571 1.078 . . . . 5.46 112.432 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.39 -25.92 62.63 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.033 1.333 . . . . 1.46 113.187 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -90.62 -43.85 9.9 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.85 1.66 . . . . 2.07 112.52 170.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -63.54 -21.89 66.59 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 120.48 -1.388 . . . . 3.79 113.502 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -78.8 -45.17 21.55 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.03 0.932 . . . . 2.54 111.924 175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 13.4 p -79.16 -32.79 15.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 C-N-CA 124.952 1.301 . . . . 2.47 111.201 -174.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.55 -22.32 32.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.634 1.174 . . . . 2.89 113.941 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.3 tt -98.05 -46.15 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.334 1.054 . . . . 4.48 112.107 167.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.16 -39.78 93.8 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.418 1.008 . . . . 4.41 113.309 -174.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -65.75 -28.15 68.82 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 126.468 1.907 . . . . 5.17 114.03 177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.93 -25.09 13.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.239 1.416 . . . . 4.63 111.687 -172.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.68 162.28 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 128.454 2.702 . . . . 7.31 114.201 -173.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 -75.52 -58.18 3.44 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.982 -1.074 . . . . 14.63 111.645 -170.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 17.2 mm 60.56 137.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 126.853 2.061 . . . . 13.13 114.6 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -66.35 -35.98 91.0 Favored Glycine 0 CA--C 1.532 1.133 0 O-C-N 120.366 -1.459 . . . . 17.29 113.355 -173.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -79.94 9.04 5.82 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.894 1.813 . . . . 17.2 115.894 -178.685 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -59.97 148.04 36.71 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.973 1.309 . . . . 20.33 112.544 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -72.05 154.2 41.27 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.953 0.901 . . . . 23.16 111.615 169.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 23.8 m -70.9 178.44 3.15 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.848 -1.158 . . . . 25.14 112.71 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 21.4 pt -56.59 162.81 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.892 1.441 . . . . 28.7 114.892 -169.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 46.4 tp -107.18 142.94 36.11 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.635 1.974 . . . . 28.0 112.089 -174.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.515 HD12 ' H ' ' A' ' 672' ' ' HIS . 51.3 tp -72.86 155.28 40.07 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.785 1.032 . . . . 32.82 113.785 -175.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.515 ' H ' HD12 ' A' ' 671' ' ' LEU . 68.4 t60 . . . . . 0 C--O 1.251 1.179 0 C-N-CA 128.981 2.913 . . . . 35.95 116.352 -170.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 29.4 m120 . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 115.027 1.491 . . . . 6.61 115.027 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 15.5 t -51.4 -30.4 18.99 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.427 1.891 . . . . 3.62 114.914 -172.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -51.51 -28.95 14.96 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.58 1.326 . . . . 3.9 114.58 170.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -72.4 -30.04 64.3 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.775 1.23 . . . . 4.58 112.978 173.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 42.1 mt -78.47 -51.4 10.05 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.341 1.056 . . . . 3.55 111.067 -175.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -33.99 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 122.978 0.511 . . . . 1.9 111.695 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.9 -2.64 4.06 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.913 1.685 . . . . 2.56 115.229 175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.2 t -74.68 -31.69 61.98 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.864 1.266 . . . . 4.59 110.633 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.84 135.93 94.7 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.659 1.184 . . . . 2.97 112.357 174.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.39 -12.55 36.13 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.3 2.667 . . . . 2.27 113.586 174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -71.93 -24.01 61.56 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.325 1.45 . . . . 2.68 112.775 169.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -105.72 13.44 29.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.448 2.299 . . . . 2.86 112.361 176.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.64 -33.61 66.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.873 1.669 . . . . 2.46 114.207 -174.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -121.99 -2.36 9.22 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.881 2.472 . . . . 2.93 112.248 -166.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -59.42 144.62 46.37 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.833 2.053 . . . . 1.69 114.388 -172.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -66.61 129.21 94.11 Favored Pre-proline 0 N--CA 1.474 0.737 0 O-C-N 121.581 -0.7 . . . . 2.27 110.281 171.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -61.04 -15.56 40.0 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.577 2.851 . . . . 1.76 114.379 -172.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -91.23 -38.01 12.96 Favored 'General case' 0 N--CA 1.461 0.123 0 C-N-CA 123.913 0.885 . . . . 2.28 111.336 -179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -59.19 -46.33 88.72 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.782 1.233 . . . . 2.08 110.769 171.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.5 m -67.03 -31.74 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 N-CA-C 112.81 0.67 . . . . 1.91 112.81 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.2 m -80.8 -41.79 22.77 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.779 1.631 . . . . 1.14 112.943 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.08 -18.6 61.23 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.27 1.028 . . . . 0.81 112.331 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.3 ttm -75.15 -33.09 61.48 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.143 1.777 . . . . 1.12 113.832 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 15.7 mt -80.65 -5.76 57.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.017 1.727 . . . . 1.31 113.674 -167.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 32.8 p -49.15 -36.1 18.38 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.474 1.51 . . . . 2.0 114.699 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -96.2 5.66 50.54 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.891 1.676 . . . . 3.08 115.231 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.452 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.2 tp -68.57 143.54 54.85 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.155 1.169 . . . . 2.18 114.155 -155.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.21 150.1 34.79 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.582 1.553 . . . . 1.89 112.611 -173.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -124.98 142.19 51.64 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.554 1.941 . . . . 2.84 111.36 -171.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -141.86 151.69 42.95 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.397 1.479 . . . . 3.15 112.318 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.535 HG11 ' CE1' ' A' ' 627' ' ' TYR . 14.0 t -132.78 142.11 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.826 1.251 . . . . 1.04 111.625 176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -133.86 145.84 50.05 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.061 1.344 . . . . 2.18 111.022 172.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -88.37 166.57 22.75 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 126.009 1.724 . . . . 2.1 112.513 -178.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.01 128.27 26.04 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.72 2.28 . . . . 1.2 114.79 -169.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.76 -9.64 66.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 126.048 1.785 . . . . 1.24 113.498 174.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -83.9 129.56 34.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.473 1.136 . . . . 2.32 112.184 -168.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -66.2 112.22 3.83 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.442 -0.786 . . . . 2.36 111.406 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.5 pt -79.43 -25.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 113.719 1.007 . . . . 1.34 113.719 -169.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 66.5 mt -129.47 143.7 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.666 1.587 . . . . 1.83 111.132 -171.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -126.88 102.18 6.91 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.75 1.62 . . . . 8.17 109.478 165.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -92.41 155.39 17.91 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.123 0.969 . . . . 4.89 113.207 176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 147.27 17.13 0.12 Allowed Glycine 0 CA--C 1.537 1.434 0 C-N-CA 128.18 2.8 . . . . 4.03 113.362 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.9 t -136.51 171.82 13.93 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.318 1.559 . . . . 3.24 113.526 -164.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 4.1 mp -107.87 129.94 61.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 126.112 1.765 . . . . 3.22 111.705 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 89.2 28.47 20.18 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.945 1.736 . . . . 2.26 114.372 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -66.6 147.0 53.88 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.427 1.091 . . . . 4.23 111.878 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -83.58 171.43 13.33 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.993 1.317 . . . . 3.43 112.022 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 15.1 tpt -89.22 135.5 33.54 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.008 0.923 . . . . 2.55 110.561 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -128.17 132.46 48.87 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.694 1.235 . . . . 2.84 111.652 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . 0.413 ' CE1' ' CE2' ' A' ' 631' ' ' TYR 0.258 0.0 OUTLIER -155.39 164.0 39.32 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.649 -0.705 . . . . 3.31 112.668 -171.134 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.1 mt -100.28 104.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 121.135 -0.978 . . . . 0.88 111.698 -155.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -64.85 -47.86 76.38 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.375 0.67 . . . . 3.19 111.021 172.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -156.95 139.24 14.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.993 1.317 . . . . 2.56 112.135 175.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 132.92 -147.42 18.94 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 120.806 -1.184 . . . . 0.98 110.596 165.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 40.1 t -143.49 148.54 19.0 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 125.091 1.356 . . . . 0.75 108.873 174.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.3 m -122.0 154.52 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.768 1.627 . . . . 0.72 110.782 169.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.45 123.28 49.89 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.68 -1.6 . . . . 1.69 106.68 170.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.1 p -142.57 151.62 17.88 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 106.848 -1.538 . . . . 2.79 106.848 -142.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.38 128.46 50.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 106.686 -1.598 . . . . 2.55 106.686 161.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.15 136.62 33.46 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.728 1.149 . . . . 4.34 111.847 169.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . 0.415 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.0 OUTLIER -61.82 144.37 54.9 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.682 -0.636 . . . . 8.12 110.287 172.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 78.71 -21.69 3.72 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.29 0.948 . . . . 6.62 115.182 -162.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -137.74 -153.9 0.51 Allowed 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 118.306 1.053 . . . . 6.08 112.692 -150.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.7 168.42 9.26 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 125.562 1.545 . . . . 4.99 114.4 -161.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -66.81 132.84 48.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.725 0.774 . . . . 3.83 111.717 162.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 45.5 mtm -135.15 176.38 8.72 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 125.491 1.517 . . . . 2.8 111.598 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.7 149.62 23.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.765 1.626 . . . . 1.71 112.357 139.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -119.91 147.96 44.09 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.622 1.569 . . . . 1.24 110.562 170.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 34.5 p -114.11 172.23 7.12 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.838 1.655 . . . . 1.81 113.522 -167.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -51.52 140.14 18.69 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.733 -1.229 . . . . 2.51 112.841 174.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 79.43 1.65 86.53 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-O 118.815 -0.992 . . . . 1.5 115.341 -174.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 15.7 m -93.09 174.04 7.43 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.37 1.868 . . . . 1.3 112.548 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -146.53 157.14 43.69 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.446 0.906 . . . . 3.86 113.446 -172.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -153.38 174.12 14.76 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 114.18 1.178 . . . . 2.24 114.18 177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 74.59 162.46 9.17 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.434 1.016 . . . . 3.07 113.707 -171.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 55.22 168.14 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 127.513 2.325 . . . . 8.26 116.816 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 67.6 mt -117.21 -46.13 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 126.539 1.936 . . . . 6.21 109.775 173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 42.2 t -160.98 133.43 6.08 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 123.057 0.543 . . . . 6.22 110.78 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.492 HD23 ' HB ' ' A' ' 635' ' ' VAL . 2.4 mp -60.37 -1.61 0.37 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.96 1.837 . . . . 3.06 115.96 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.6 mp -122.73 -7.17 8.53 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.483 1.913 . . . . 5.06 113.283 176.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.3 t -87.09 148.99 25.0 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.998 0.817 . . . . 2.86 112.857 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 48.9 mtm105 -65.98 160.16 24.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.42 1.488 . . . . 8.04 113.577 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -65.3 -167.71 1.86 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.809 1.671 . . . . 2.88 114.423 -177.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 58.32 46.67 15.14 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.812 0.845 . . . . 3.9 112.616 -169.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.0 173.5 4.51 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.029 0.532 . . . . 6.44 110.693 162.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 5.9 t -124.34 147.9 47.86 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.208 1.003 . . . . 4.09 111.713 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -157.26 147.6 21.04 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.898 0.879 . . . . 2.17 113.221 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 48.2 m -146.33 103.59 3.71 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.379 1.472 . . . . 2.18 111.07 174.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.5 p -155.52 146.46 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 O-C-N 120.741 -1.225 . . . . 1.05 113.902 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -130.13 160.81 32.65 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.83 2.052 . . . . 3.71 112.117 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.72 135.05 52.13 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.319 -0.863 . . . . 0.81 110.63 174.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -75.91 -37.45 58.75 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.953 -1.092 . . . . 2.32 110.121 170.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.6 t -146.32 -176.73 5.28 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.854 2.462 . . . . 0.86 107.83 -161.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.535 ' CE1' HG11 ' A' ' 564' ' ' VAL . 0.4 OUTLIER -62.39 98.01 0.1 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 107.513 -1.292 . . . . 3.11 107.513 163.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.0 p -99.93 135.97 40.54 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.863 1.665 . . . . 2.27 109.859 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -107.6 111.41 23.64 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 126.485 1.914 . . . . 2.81 107.356 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 24.9 mt -111.28 157.51 20.07 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 124.619 1.167 . . . . 0.87 110.115 -174.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . 0.413 ' CE2' ' CE1' ' A' ' 583' ' ' PHE . 9.2 p90 -124.6 149.23 47.27 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.343 1.057 . . . . 6.6 109.368 172.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 31.9 p -134.15 117.97 17.15 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.897 0.703 . . . . 2.14 112.897 -171.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.452 ' HG ' HD13 ' A' ' 560' ' ' LEU . 1.5 tt -118.19 125.97 51.25 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.496 1.518 . . . . 1.27 110.438 -170.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 84.5 p -82.85 143.97 30.41 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.366 1.067 . . . . 2.23 113.74 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.492 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.9 m -82.92 -24.21 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 O-C-N 121.005 -1.059 . . . . 1.87 111.28 -172.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.35 -52.3 38.2 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.049 0.939 . . . . 4.54 111.339 170.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -65.56 -28.37 69.11 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 117.711 -1.138 . . . . 3.14 112.759 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' A' ' 612' ' ' LEU . 19.0 t80 -72.8 -49.92 27.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.386 1.474 . . . . 2.49 111.468 175.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -63.68 -20.98 66.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.487 1.115 . . . . 2.06 111.595 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.07 -53.84 6.33 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.148 1.536 . . . . 4.62 115.148 172.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.66 -24.12 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 125.093 1.357 . . . . 0.97 112.49 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -28.16 66.88 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 113.64 0.978 . . . . 2.34 113.64 176.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -76.34 -9.88 58.97 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.847 -1.158 . . . . 3.8 113.603 177.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -77.0 -25.07 52.24 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 120.21 -1.556 . . . . 2.23 113.175 173.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -126.38 64.26 54.7 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.38 1.472 . . . . 2.23 110.263 -172.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -59.91 -21.6 65.12 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.413 2.742 . . . . 1.57 116.058 -166.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -62.09 -31.45 71.89 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 121.011 1.732 . . . . 1.99 110.598 172.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . 0.526 ' HA ' ' HB3' ' A' ' 651' ' ' ALA . 28.2 tpp -84.73 -20.01 31.79 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.236 1.814 . . . . 2.69 110.787 -177.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.0 tmm_? -65.41 -52.46 53.21 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.084 0.953 . . . . 4.84 110.348 170.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -62.0 -37.11 83.6 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-N 119.522 1.055 . . . . 5.91 113.123 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' A' ' 648' ' ' MET . . . -61.88 -18.93 61.92 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.408 1.083 . . . . 2.09 112.961 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.63 -42.64 10.65 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.143 1.777 . . . . 2.41 113.365 168.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.7 -26.13 61.29 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 120.051 1.296 . . . . 3.08 114.025 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.1 t -86.89 -20.67 27.07 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 127.235 2.214 . . . . 3.02 113.875 -177.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -104.8 -29.33 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.624 1.57 . . . . 3.04 112.622 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.53 -36.35 64.16 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.67 1.188 . . . . 3.57 112.276 174.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.8 pp -66.3 -8.47 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 114.694 1.368 . . . . 6.24 114.694 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -103.7 -38.58 7.02 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.88 1.272 . . . . 7.22 112.459 164.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -80.44 -13.4 59.16 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.476 1.511 . . . . 8.4 114.572 -174.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.9 tt -101.47 -21.73 14.7 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.494 1.518 . . . . 7.11 113.884 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -139.06 175.86 9.19 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 125.648 1.579 . . . . 9.15 110.543 -175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -92.12 -9.39 42.71 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 118.22 2.674 . . . . 12.58 118.22 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . 0.647 HD12 ' H ' ' A' ' 663' ' ' ILE . 0.8 OUTLIER -68.4 -36.63 75.69 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 116.874 2.175 . . . . 9.93 116.874 -157.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 91.44 18.45 45.41 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.059 1.314 . . . . 14.03 116.048 -175.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -117.27 137.47 52.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.963 2.105 . . . . 15.14 110.481 -176.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -135.45 155.85 49.87 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.45 1.1 . . . . 22.37 113.465 -171.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -107.97 174.48 5.86 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.633 1.973 . . . . 22.14 112.765 175.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.6 p -134.26 -145.72 0.24 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.798 1.239 . . . . 25.42 112.165 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.3 pt -84.09 166.84 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 125.093 1.357 . . . . 31.2 112.893 -175.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 97.0 mt -95.13 149.06 21.7 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.089 0.956 . . . . 31.6 109.234 156.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.9 tp -144.06 168.45 19.98 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 122.763 1.268 . . . . 35.08 114.192 -167.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.253 1.264 0 C-N-CA 129.766 3.226 . . . . 41.85 112.414 169.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 59.9 t30 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 120.784 0.326 . . . . 6.75 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 67.4 m 70.01 12.88 7.86 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 116.899 2.185 . . . . 3.78 116.899 171.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -61.44 -48.12 82.6 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.222 1.374 . . . . 5.63 112.16 177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.22 -30.56 69.65 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 118.589 0.631 . . . . 5.92 112.091 176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 53.7 tp -70.62 -46.57 63.12 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.317 1.047 . . . . 2.16 111.11 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.67 -41.84 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.115 0.566 . . . . 1.17 111.097 172.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.48 20.72 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.894 1.442 . . . . 1.56 114.894 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 11.9 m -92.48 -9.13 42.54 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.494 1.043 . . . . 2.95 113.139 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 25.5 mtp -69.72 156.26 92.02 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 126.109 1.764 . . . . 2.64 113.063 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.21 -25.45 50.19 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.43 2.753 . . . . 1.72 112.486 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 4.8 mt -76.75 -9.59 58.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.589 1.156 . . . . 3.39 113.191 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 45.8 m-85 -113.96 14.24 18.42 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.035 2.134 . . . . 2.41 112.337 -178.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.61 -30.26 30.37 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.617 1.967 . . . . 1.67 114.83 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.05 4.76 8.62 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 127.809 2.444 . . . . 2.85 112.129 -170.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.477 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -60.84 142.93 55.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.466 1.284 . . . . 1.1 114.466 -168.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.72 135.75 45.61 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.257 1.423 . . . . 1.85 110.777 167.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.59 -15.03 46.17 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.067 2.512 . . . . 1.43 114.645 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -92.77 -36.99 12.58 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.259 0.936 . . . . 2.48 111.251 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.17 -48.07 82.96 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.625 1.17 . . . . 2.3 110.986 171.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.477 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.4 m -64.06 -34.58 69.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 112.134 0.42 . . . . 1.57 112.134 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 25.9 m -80.7 -40.12 25.93 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.476 1.51 . . . . 1.54 113.152 -176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.12 -17.26 38.95 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 118.778 0.717 . . . . 1.13 112.645 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 9.9 ttm -76.5 -27.12 55.92 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.861 1.664 . . . . 0.76 113.82 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.0 mt -80.79 -17.5 50.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.454 1.502 . . . . 1.16 113.781 -169.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 1.2 t -62.07 -20.54 64.1 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.993 1.849 . . . . 2.87 115.993 -165.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.65 1.2 9.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.249 1.82 . . . . 2.74 114.694 173.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.9 tt -74.96 126.85 31.88 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.629 1.572 . . . . 2.67 111.136 -159.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.65 143.17 42.98 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.216 1.807 . . . . 2.86 114.446 -160.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.64 148.93 24.96 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.763 1.225 . . . . 2.13 112.968 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -141.05 162.07 36.35 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.265 1.426 . . . . 3.65 112.194 -176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 11.0 t -135.59 146.41 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 120.753 -1.217 . . . . 0.84 111.63 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -130.12 144.01 51.11 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.689 1.196 . . . . 2.14 110.941 169.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -86.57 163.1 43.02 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 124.475 1.11 . . . . 2.87 111.184 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -60.61 127.75 23.68 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.561 2.174 . . . . 0.9 113.173 -173.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 96.41 -3.56 63.75 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.278 1.418 . . . . 1.05 114.068 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -89.52 130.47 35.85 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.154 0.977 . . . . 2.12 112.124 -174.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -64.8 116.37 6.24 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.692 -0.63 . . . . 2.49 110.249 174.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.6 pt -77.64 -32.8 18.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 123.026 0.53 . . . . 1.07 111.861 -173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 65.9 mt -129.55 137.51 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 126.899 2.08 . . . . 1.65 109.581 -171.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -133.26 99.06 4.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.401 1.08 . . . . 7.44 108.901 162.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.1 163.23 22.96 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.334 0.588 . . . . 4.93 111.274 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 156.69 22.83 0.03 OUTLIER Glycine 0 CA--C 1.527 0.821 0 CA-C-O 117.589 -1.673 . . . . 3.43 114.874 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 3.6 t -141.31 153.15 45.0 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-N 121.161 2.481 . . . . 2.7 116.316 176.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.6 mp -74.8 126.88 36.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 106.928 -1.508 . . . . 2.05 106.928 169.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.57 18.25 49.25 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 118.755 -1.025 . . . . 1.65 114.927 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 154.69 10.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.006 1.722 . . . . 7.35 114.936 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -88.18 170.37 11.09 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 114.118 1.155 . . . . 3.92 114.118 -174.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -103.4 148.07 26.34 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.187 1.395 . . . . 2.25 113.063 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.82 147.38 37.15 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.674 1.189 . . . . 3.04 112.565 -175.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.8 p90 -150.35 158.44 44.15 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.843 1.423 . . . . 2.81 114.843 -175.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.452 HD12 ' HB2' ' A' ' 605' ' ' SER . 8.6 mt -97.64 115.91 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.593 1.157 . . . . 0.78 111.463 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -94.04 -41.7 9.41 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.24 0.616 . . . . 2.6 111.803 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -155.92 112.4 3.13 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.865 1.266 . . . . 3.23 110.465 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.82 -155.84 26.36 Favored Glycine 0 CA--C 1.523 0.544 0 C-N-CA 124.182 0.896 . . . . 0.98 110.971 170.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 78.4 t -142.12 151.37 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.221 1.808 . . . . 0.92 108.252 175.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.4 m -125.74 148.38 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.663 1.185 . . . . 0.7 110.954 172.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -112.25 124.58 52.76 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 106.159 -1.793 . . . . 1.13 106.159 170.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.07 151.17 18.63 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 N-CA-C 106.636 -1.616 . . . . 2.52 106.636 -142.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -118.23 131.75 56.35 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.641 -0.874 . . . . 2.0 108.641 167.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.76 125.23 44.05 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 119.637 -0.825 . . . . 2.33 111.909 161.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.36 134.29 56.26 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.383 1.073 . . . . 4.5 111.285 173.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 95.28 -31.75 6.8 Favored Glycine 0 N--CA 1.47 0.93 0 C-N-CA 123.486 0.565 . . . . 3.88 113.935 -162.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -125.83 -147.78 0.37 Allowed 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.745 0.818 . . . . 3.69 109.529 -154.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.58 168.07 9.42 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 125.371 1.469 . . . . 3.59 114.686 -169.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.88 131.06 43.88 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.82 -1.082 . . . . 3.1 110.191 156.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 58.0 ttp -140.45 175.42 9.61 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 127.154 2.182 . . . . 1.87 110.658 -161.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.54 153.23 34.55 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 129.213 3.005 . . . . 2.19 115.277 160.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.2 mp -134.16 150.51 51.11 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.711 2.004 . . . . 0.88 110.295 168.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.5 p -120.77 172.54 7.81 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.244 1.418 . . . . 1.66 113.882 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.66 137.3 37.62 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.03 0.932 . . . . 2.15 113.285 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 95.91 -6.58 67.04 Favored Glycine 0 CA--C 1.535 1.324 0 N-CA-C 115.429 0.932 . . . . 1.12 115.429 -168.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.452 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.3 m -89.62 167.39 12.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.23 1.412 . . . . 0.85 112.392 174.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 21.9 p90 -143.92 165.37 27.91 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 113.938 1.088 . . . . 3.63 113.938 173.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -153.83 -179.04 7.46 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.049 1.34 . . . . 2.27 112.609 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 95.89 59.98 1.04 Allowed Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.147 1.356 . . . . 3.05 112.02 -164.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -50.84 123.66 9.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 115.364 1.616 . . . . 6.56 115.364 -166.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 38.3 mt 37.68 99.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 131.469 3.908 . . . . 5.8 115.316 167.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 6.7 p -125.7 -114.69 0.28 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.164 1.386 . . . . 5.09 112.065 161.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.785 HD23 HG22 ' A' ' 635' ' ' VAL . 61.9 mt 46.14 -75.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.279 3.032 . . . . 2.17 115.331 -173.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -13.67 26.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.377 2.271 . . . . 4.3 114.413 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.9 t -105.5 158.2 16.84 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.591 0.757 . . . . 3.49 110.626 168.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -130.65 96.34 4.08 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.452 1.101 . . . . 7.95 109.605 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.04 140.2 3.09 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 124.264 0.935 . . . . 1.91 112.985 -170.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.8 ptt180 -69.82 126.48 29.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.282 1.033 . . . . 3.71 110.559 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -134.71 106.74 7.08 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.137 1.375 . . . . 6.38 110.001 -173.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.0 m -87.37 152.95 21.84 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.733 1.012 . . . . 3.14 113.733 -155.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.36 171.87 15.84 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.149 1.78 . . . . 1.64 110.693 163.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 t -136.65 126.22 25.28 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.095 1.358 . . . . 2.58 110.95 172.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -155.12 144.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 121.191 -0.943 . . . . 0.92 112.602 178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.0 160.0 24.44 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.785 1.234 . . . . 4.69 113.176 172.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.65 129.3 39.27 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.447 0.699 . . . . 0.72 110.699 171.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.59 -24.43 56.58 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 122.191 0.996 . . . . 2.1 111.62 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.9 t -155.03 -178.86 7.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.62 -1.173 . . . . 0.86 108.899 -162.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -64.96 100.67 0.43 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 106.859 -1.534 . . . . 3.21 106.859 163.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.8 p -106.88 125.21 50.71 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.876 1.27 . . . . 2.09 109.085 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -100.39 120.69 40.35 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.646 1.178 . . . . 3.96 109.589 173.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 18.2 mt -122.95 178.24 5.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 127.016 2.126 . . . . 1.04 109.6 -169.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -132.66 157.41 44.9 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.862 1.265 . . . . 7.25 111.543 176.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 59.5 m -129.36 133.19 47.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.926 0.891 . . . . 1.98 113.364 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.6 tt -136.99 114.94 11.42 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.723 0.809 . . . . 1.38 110.809 -177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 35.1 t -57.06 119.71 6.78 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.515 0.726 . . . . 1.94 109.371 170.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.785 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -52.04 -38.84 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 122.912 1.339 . . . . 2.62 110.902 176.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -71.6 -29.67 64.95 Favored 'General case' 0 N--CA 1.433 -1.294 0 CA-C-N 114.739 -1.119 . . . . 2.68 111.107 -169.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -71.95 -34.68 69.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.25 1.02 . . . . 3.71 111.323 176.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.8 -49.36 77.98 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.675 1.19 . . . . 2.94 110.374 166.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -65.08 -18.76 65.57 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.522 0.934 . . . . 2.71 113.522 176.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -91.13 -42.58 10.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.221 2.208 . . . . 3.71 112.69 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -66.0 -26.79 39.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.719 0.808 . . . . 1.2 111.927 168.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.6 tp -46.13 -37.68 7.22 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.321 1.449 . . . . 3.06 114.488 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -88.23 -15.58 35.52 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.627 1.171 . . . . 4.64 112.483 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.33 -18.14 60.08 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.595 -1.316 . . . . 2.81 112.64 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -131.89 65.32 75.27 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 126.944 2.097 . . . . 2.42 108.592 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.29 -5.82 7.33 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.575 3.516 . . . . 1.67 116.954 -161.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 16.7 ptt? -69.34 -32.46 71.57 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 120.466 1.484 . . . . 1.79 111.994 163.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 1.2 mmt -77.34 -30.63 54.01 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.669 1.988 . . . . 1.88 110.987 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -51.26 -61.12 2.43 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.364 0.666 . . . . 4.79 110.098 162.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 13.3 ttt85 -58.19 -40.04 80.51 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.129 0.418 . . . . 5.28 112.129 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.53 -25.36 59.76 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.44 1.096 . . . . 1.52 113.382 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -92.14 -19.81 21.9 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.833 1.253 . . . . 2.49 114.313 168.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -80.83 -31.14 35.61 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 119.743 -1.848 . . . . 3.81 112.89 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.0 t -68.57 -18.09 64.27 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.146 1.378 . . . . 2.76 112.563 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.45 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 127.373 2.269 . . . . 2.55 113.068 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.32 -23.89 57.96 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.479 1.289 . . . . 2.9 114.479 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -70.64 -24.38 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.603 1.161 . . . . 4.43 113.287 172.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -95.09 -48.45 5.95 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.958 1.303 . . . . 5.86 111.647 177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 92.1 mtt-85 -64.82 -10.64 29.62 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.28 1.832 . . . . 6.85 114.213 174.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 67.6 tp -38.75 -46.35 1.24 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.57 1.948 . . . . 5.62 112.404 161.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -93.45 132.15 37.98 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.452 1.101 . . . . 7.85 112.355 177.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 3.2 ppt_? -79.82 4.49 16.36 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.223 2.209 . . . . 14.77 116.375 -176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.3 1.2 mp 49.26 153.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 C-N-CA 130.662 3.585 . . . . 13.46 116.785 -170.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -69.04 152.98 52.68 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 120.818 -1.177 . . . . 16.42 110.515 162.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.43 168.74 9.39 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.074 0.949 . . . . 19.93 113.164 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 75.7 tttt -73.75 44.91 0.18 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.799 2.04 . . . . 28.5 112.358 173.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -63.2 145.75 54.84 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.244 1.418 . . . . 27.14 113.236 -163.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 72.1 p -158.81 -176.9 6.14 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.292 1.437 . . . . 30.88 112.651 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.7 pt -101.92 154.4 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.0 1.32 . . . . 37.16 113.494 -162.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 72.7 mt -127.3 168.48 14.72 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.906 1.682 . . . . 38.21 112.467 176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.435 HD12 ' H ' ' A' ' 672' ' ' HIS . 60.3 tp -66.94 153.97 42.24 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.685 1.994 . . . . 44.67 113.617 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.435 ' H ' HD12 ' A' ' 671' ' ' LEU . 20.4 t-80 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 129.534 3.134 . . . . 47.66 114.162 178.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 50.9 t30 . . . . . 0 CA--C 1.542 0.666 0 CA-C-O 120.879 0.371 . . . . 7.05 111.635 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 93.8 m -99.06 141.23 32.08 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.125 0.97 . . . . 7.99 112.396 -172.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -58.11 -25.94 61.99 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.2 1.185 . . . . 6.1 114.2 -172.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -43.4 -37.67 2.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.272 1.829 . . . . 4.17 114.746 172.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 56.8 tp -69.66 -46.16 66.75 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 119.51 1.05 . . . . 2.89 111.956 -176.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.473 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.8 OUTLIER -78.54 -34.54 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 O-C-N 121.685 -0.634 . . . . 1.16 111.43 177.34 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.96 -0.82 4.75 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.015 1.326 . . . . 1.59 114.442 172.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 16.9 m -78.18 -9.7 59.31 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.833 -1.167 . . . . 2.61 112.008 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 88.3 mtp -88.23 144.19 33.85 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 127.11 2.164 . . . . 2.56 112.522 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.88 -25.46 32.84 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.677 2.918 . . . . 1.91 112.858 175.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.8 tt -61.74 -20.17 63.22 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.667 -1.271 . . . . 2.45 113.399 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . 0.473 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 58.2 m-85 -105.39 6.62 32.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.727 2.011 . . . . 2.25 113.448 175.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -54.11 -35.32 62.01 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.107 1.363 . . . . 1.64 114.204 -176.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -111.01 13.16 22.04 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.146 2.178 . . . . 2.73 110.913 -171.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -70.72 149.14 47.23 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 114.763 1.394 . . . . 1.04 114.763 -171.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -77.79 128.01 80.51 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 126.058 1.743 . . . . 2.32 110.322 168.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -62.23 -14.08 36.12 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.784 2.989 . . . . 1.08 114.694 -172.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -91.27 -40.33 11.57 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.067 1.347 . . . . 2.03 110.38 178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -57.76 -47.92 81.12 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.229 1.011 . . . . 2.15 111.241 173.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.2 m -65.1 -32.01 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 122.817 0.447 . . . . 1.42 112.093 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.0 m -81.39 -43.95 18.24 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.687 1.595 . . . . 0.9 113.188 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -65.39 -16.72 63.9 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 120.656 -1.278 . . . . 0.73 112.353 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 31.4 ttm -65.3 -31.35 72.45 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.1 1.36 . . . . 1.1 112.642 169.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 26.2 mt -85.48 -13.91 47.67 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.142 1.377 . . . . 0.96 114.068 -167.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 34.7 p -60.98 -25.38 66.82 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 115.087 1.514 . . . . 1.87 115.087 -170.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.48 16.09 10.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.645 1.578 . . . . 2.8 114.153 172.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -82.81 144.67 29.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.184 1.793 . . . . 2.63 110.289 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 152.1 46.76 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.021 1.489 . . . . 3.25 115.021 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.53 158.62 17.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.212 1.005 . . . . 2.95 112.659 170.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.9 164.79 29.12 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.805 1.242 . . . . 5.3 111.718 176.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.56 HG11 ' CE1' ' A' ' 627' ' ' TYR . 58.1 t -119.85 150.39 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 120.664 -1.272 . . . . 1.24 112.467 174.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.43 ' CD2' HG22 ' A' ' 571' ' ' ILE . 49.2 m-85 -127.12 147.65 50.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.861 1.265 . . . . 2.51 111.316 167.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -89.15 164.03 32.13 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 125.641 1.576 . . . . 3.06 111.975 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -61.21 130.58 32.82 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.829 2.353 . . . . 1.64 112.776 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 94.41 -5.63 70.91 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 125.289 1.423 . . . . 1.85 113.274 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -85.02 129.04 34.87 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 119.114 1.457 . . . . 2.69 112.706 -175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -78.17 109.39 12.23 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.818 1.247 . . . . 2.31 109.647 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.43 HG22 ' CD2' ' A' ' 565' ' ' PHE . 8.1 pt -77.23 -36.39 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.332 1.053 . . . . 1.34 113.119 -169.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 1.3 mp -100.94 150.11 5.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 126.345 1.858 . . . . 1.82 110.853 -174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -151.16 105.19 3.19 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.5 1.12 . . . . 7.3 112.104 175.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -92.14 152.04 20.1 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 122.386 1.088 . . . . 5.25 113.322 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 159.74 -1.23 0.09 OUTLIER Glycine 0 CA--C 1.534 1.253 0 C-N-CA 126.975 2.226 . . . . 3.91 114.159 -174.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.0 t -169.8 156.68 6.45 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.611 2.206 . . . . 2.83 111.477 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.49 133.24 31.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 O-C-N 121.357 -0.839 . . . . 2.33 109.432 -175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 115.98 12.74 8.99 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 124.465 1.031 . . . . 1.75 115.659 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -58.66 154.15 15.08 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.063 1.432 . . . . 4.42 112.288 169.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -93.85 -178.6 4.72 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.315 1.446 . . . . 6.02 114.362 -165.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 13.7 tpt -92.75 135.59 33.98 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.078 1.351 . . . . 1.74 111.923 176.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -141.25 138.68 33.42 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.143 0.977 . . . . 2.92 111.597 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -148.36 160.63 42.82 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.423 0.897 . . . . 2.52 113.423 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.527 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -99.43 114.53 37.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.721 1.208 . . . . 0.84 110.699 -164.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 -53.33 7.18 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 121.876 -0.515 . . . . 3.94 110.232 175.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -156.96 125.31 5.65 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.485 1.114 . . . . 3.03 112.405 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 139.8 -157.34 25.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 124.827 1.203 . . . . 1.06 111.412 174.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 43.6 t -139.98 140.0 36.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 123.887 0.875 . . . . 1.27 110.212 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 26.8 m -117.6 152.98 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.244 1.418 . . . . 0.82 110.555 169.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.6 m -117.15 126.98 53.66 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.47 1.908 . . . . 1.43 107.424 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . 0.451 HG12 ' O ' ' A' ' 599' ' ' MET . 2.8 p -144.16 151.99 15.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 114.886 -1.052 . . . . 2.62 108.582 -138.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -122.2 127.98 50.65 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.944 -0.762 . . . . 2.68 108.944 167.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.4 p -87.06 138.68 31.28 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 113.597 0.962 . . . . 3.05 113.597 165.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.0 137.41 58.25 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.816 -0.552 . . . . 5.87 111.232 178.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.56 -23.08 9.15 Favored Glycine 0 N--CA 1.468 0.812 0 C-N-CA 124.511 1.053 . . . . 4.38 114.625 -167.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.524 ' HB3' ' HE2' ' A' ' 597' ' ' LYS . 10.7 m-20 -136.04 -145.17 0.21 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 121.832 0.825 . . . . 3.96 112.154 -147.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.524 ' HE2' ' HB3' ' A' ' 596' ' ' ASN . 5.8 mmtt -101.27 170.66 8.09 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 125.717 1.607 . . . . 3.86 114.236 -155.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . 0.251 10.8 pt-20 -90.6 122.83 33.74 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 113.084 -1.871 . . . . 4.46 111.69 166.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . 0.451 ' O ' HG12 ' A' ' 591' ' ' VAL . 46.7 mtm -127.27 177.18 6.87 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.712 2.405 . . . . 1.87 112.14 -169.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -107.04 155.92 19.31 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.862 1.665 . . . . 2.33 114.051 145.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -130.58 154.39 47.89 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.591 2.356 . . . . 0.94 109.714 166.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 20.1 t -147.39 -174.26 4.48 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.959 0.903 . . . . 3.46 112.344 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -41.6 137.22 1.65 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.343 2.257 . . . . 2.38 115.598 -168.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 78.71 3.11 86.89 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 125.976 1.751 . . . . 1.2 115.409 -176.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.527 ' HB2' HD12 ' A' ' 584' ' ' ILE . 33.9 m -90.18 166.64 13.26 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.847 1.259 . . . . 0.94 112.688 175.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.81 151.3 33.32 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.403 0.89 . . . . 3.41 113.403 -174.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 -177.65 6.17 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.369 1.468 . . . . 2.23 112.08 -175.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 133.35 -8.8 5.04 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.183 -1.343 . . . . 3.45 115.786 169.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 59.87 -36.14 0.07 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 130.126 3.37 . . . . 5.92 118.765 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.5 mp -79.6 138.17 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 120.577 -1.327 . . . . 8.3 108.761 175.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 1.8 t -119.6 165.34 14.57 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.805 1.409 . . . . 5.13 114.805 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.788 HD23 HG22 ' A' ' 635' ' ' VAL . 7.2 mt -57.35 -30.7 65.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.022 2.529 . . . . 2.25 114.005 -163.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.4 mp -122.38 8.2 9.63 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.233 1.413 . . . . 5.4 112.517 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.91 159.27 7.19 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.917 1.451 . . . . 3.86 114.917 -172.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 27.6 ttt85 -128.88 131.65 47.65 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.924 1.69 . . . . 9.08 111.482 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 71.37 165.24 6.61 Favored Glycine 0 CA--C 1.542 1.764 0 N-CA-C 116.408 1.323 . . . . 3.03 116.408 175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 26.3 mmt85 -54.84 152.96 6.63 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.27 2.228 . . . . 3.46 113.636 -175.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -118.88 178.06 4.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 129.309 3.043 . . . . 6.43 110.794 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.2 t -135.96 137.06 40.91 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.491 -0.756 . . . . 4.7 111.924 158.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -159.37 146.88 17.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.146 1.379 . . . . 1.87 112.351 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.7 t -154.4 116.64 4.28 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.328 1.051 . . . . 2.22 111.904 177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -154.82 143.28 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 124.344 1.058 . . . . 1.13 111.916 175.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.61 160.93 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.688 1.595 . . . . 4.2 112.555 176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -70.0 131.52 44.49 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.601 -0.687 . . . . 1.16 111.622 176.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.57 -27.17 60.38 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.099 1.428 . . . . 2.49 111.711 169.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -160.98 167.37 26.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.343 1.857 . . . . 1.4 109.209 -159.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.56 ' CE1' HG11 ' A' ' 564' ' ' VAL . 7.1 t80 -67.71 108.65 3.01 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.318 -0.993 . . . . 4.08 108.318 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.9 t -122.51 134.76 54.55 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.166 1.386 . . . . 2.51 111.793 -162.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -81.99 113.85 20.17 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.699 1.6 . . . . 4.49 109.03 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.9 172.77 6.65 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.536 1.534 . . . . 1.27 110.972 170.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -128.75 141.31 51.36 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 126.638 1.975 . . . . 7.15 109.561 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 p -132.07 125.65 31.92 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 114.592 1.33 . . . . 2.76 114.592 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.1 tt -136.33 115.7 12.67 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.093 1.357 . . . . 1.38 109.098 -169.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 40.9 t -64.78 127.3 30.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 121.617 -0.677 . . . . 2.16 110.583 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.788 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -48.82 -43.7 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.479 0.657 . . . . 2.63 111.007 173.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.4 -25.6 61.55 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 119.764 -0.774 . . . . 3.05 111.394 -173.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -78.27 -19.37 53.81 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.113 -0.992 . . . . 2.57 112.392 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -76.59 -43.94 36.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.039 2.136 . . . . 2.76 109.725 166.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -63.06 -19.31 64.28 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.913 -1.117 . . . . 2.23 113.653 171.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.66 -46.99 34.41 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.666 1.586 . . . . 3.02 113.136 172.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.7 p -73.41 -30.57 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 124.29 1.036 . . . . 1.06 111.819 -177.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 10.3 mt -48.19 -41.69 27.84 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 113.316 0.858 . . . . 2.09 113.316 170.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.91 -21.23 65.88 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.092 1.357 . . . . 3.98 113.757 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -81.31 -21.27 39.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.608 1.963 . . . . 3.55 114.02 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -121.59 72.93 30.7 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 126.845 2.058 . . . . 2.35 109.184 -176.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.41 -21.87 31.65 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 124.393 3.395 . . . . 1.28 116.21 -171.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.04 -52.44 62.83 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.376 0.989 . . . . 1.81 111.613 165.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -35.23 79.74 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.388 -0.82 . . . . 1.53 110.502 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -54.23 40.31 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.695 0.798 . . . . 4.84 111.073 173.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -38.06 88.25 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.133 0.79 . . . . 5.6 113.133 178.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.27 -23.43 65.66 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.014 1.116 . . . . 1.75 114.014 178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -93.47 -31.08 14.72 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.276 1.584 . . . . 2.48 115.276 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -83.47 -25.31 31.26 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.407 0.892 . . . . 3.35 113.407 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 7.6 t -70.95 -39.57 72.53 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.002 0.921 . . . . 3.13 112.111 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.8 p -70.0 -36.74 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.429 1.492 . . . . 2.74 111.202 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.41 -18.34 38.29 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.354 1.242 . . . . 3.21 114.354 177.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.8 tt -108.76 -28.39 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.678 1.191 . . . . 5.27 113.701 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -72.47 -25.81 61.57 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 119.869 -1.77 . . . . 4.23 113.055 171.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 50.1 ttt85 -91.71 -16.35 27.07 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.589 1.955 . . . . 5.84 113.029 178.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 9.0 tt -74.06 -23.82 59.43 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.576 1.55 . . . . 5.03 112.651 165.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.73 156.59 34.97 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.245 1.202 . . . . 7.13 114.245 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.04 -14.32 62.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.299 2.239 . . . . 11.67 114.654 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 16.8 mm 54.69 -105.5 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.161 1.785 . . . . 11.09 111.837 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -91.97 -4.51 67.0 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 125.998 1.761 . . . . 14.51 114.717 -179.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -80.75 111.09 16.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 118.042 0.921 . . . . 14.44 109.457 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -127.67 -18.67 4.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.735 2.014 . . . . 21.21 112.731 -172.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -71.8 -35.16 69.89 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.13 0.789 . . . . 23.26 113.13 -170.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 19.4 m -77.77 179.34 6.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.899 1.279 . . . . 22.05 112.79 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 23.4 pt -69.03 158.8 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 125.945 1.698 . . . . 26.23 113.732 -172.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.13 177.41 8.83 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.639 1.576 . . . . 25.51 113.791 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.72 128.04 34.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.631 1.172 . . . . 26.73 110.495 175.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.327 0 C-N-CA 127.911 2.484 . . . . 32.8 113.625 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 107.797 -1.186 . . . . 6.78 107.797 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 24.5 t -58.72 -16.06 14.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.64 1.348 . . . . 4.39 114.64 -175.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 27.2 ptt85 -58.53 -25.59 62.61 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.943 1.461 . . . . 4.34 114.943 175.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 38.0 tttm -80.32 -29.89 38.13 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.547 1.139 . . . . 4.03 113.785 170.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.99 -49.7 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.64 1.176 . . . . 2.85 111.589 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.16 -33.96 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 124.322 1.049 . . . . 1.21 111.274 178.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -60.36 -13.58 13.94 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.716 2.007 . . . . 1.53 115.361 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 2.4 t -94.26 -4.82 48.13 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.54 1.536 . . . . 2.73 113.162 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 16.7 ttt -81.58 135.58 49.45 Favored Pre-proline 0 N--CA 1.441 -0.9 0 N-CA-C 107.945 -1.132 . . . . 2.81 107.945 162.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -62.37 -25.76 76.47 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.695 2.93 . . . . 2.12 113.717 -174.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.3 -18.44 58.51 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.317 1.047 . . . . 3.06 113.133 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -115.56 7.16 14.79 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.777 2.031 . . . . 2.31 112.256 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.55 -35.03 75.05 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.729 -1.232 . . . . 1.79 112.248 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -116.08 11.73 15.39 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 127.65 2.38 . . . . 2.96 110.917 -166.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.6 157.08 37.33 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 115.004 1.483 . . . . 1.05 115.004 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -73.13 127.5 89.19 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.318 1.047 . . . . 2.13 109.617 162.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -64.18 -17.02 58.2 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.33 2.687 . . . . 1.19 114.149 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -92.31 -33.08 14.76 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.086 -1.009 . . . . 3.04 111.602 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -58.56 -46.21 87.36 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.102 0.561 . . . . 2.35 110.724 166.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.0 m -66.85 -34.71 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 N-CA-C 112.932 0.716 . . . . 1.5 112.932 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 88.4 m -75.17 -35.63 61.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.509 1.524 . . . . 1.09 112.16 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -63.45 -19.5 64.77 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.241 -0.912 . . . . 0.9 111.539 176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.5 ttm -77.57 -12.71 59.99 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.143 1.377 . . . . 1.09 114.485 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 53.3 mt -90.41 -18.98 24.48 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.566 1.321 . . . . 1.14 114.566 -170.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.0 t -56.19 -31.27 63.28 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 115.548 1.684 . . . . 3.08 115.548 -167.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -115.69 4.03 14.0 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 114.638 1.347 . . . . 3.09 114.638 173.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . 0.265 0.0 OUTLIER -71.86 146.11 48.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.583 1.153 . . . . 2.42 110.397 -173.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.79 143.0 49.65 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.649 0.981 . . . . 2.72 113.649 -164.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -95.96 151.74 19.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.01 1.324 . . . . 2.59 112.325 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -145.71 154.76 42.42 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.468 -0.77 . . . . 3.06 112.301 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 22.0 t -123.21 147.71 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.186 1.394 . . . . 0.98 112.46 -175.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.484 ' CG ' HG22 ' A' ' 571' ' ' ILE . 97.0 m-85 -133.27 155.57 49.15 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.881 1.672 . . . . 2.18 111.139 169.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -128.69 165.31 32.46 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.41 1.484 . . . . 3.25 112.179 -169.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -56.58 112.44 1.09 Allowed 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 123.113 2.542 . . . . 1.39 113.833 -164.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 104.83 -5.55 43.18 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.583 1.563 . . . . 1.35 114.614 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -92.96 129.42 38.88 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 119.385 1.593 . . . . 2.39 112.481 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -76.0 132.06 39.93 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.442 1.497 . . . . 2.73 111.897 -178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.484 HG22 ' CG ' ' A' ' 565' ' ' PHE . 12.5 pt -98.91 -31.49 3.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 114.683 1.364 . . . . 0.93 114.683 -163.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.46 151.23 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 127.024 2.13 . . . . 1.5 112.895 -163.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -152.47 164.0 38.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.28 1.832 . . . . 7.21 111.604 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.14 156.83 39.12 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.72 1.608 . . . . 4.95 111.879 165.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -163.02 3.11 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.985 1.755 . . . . 4.75 114.409 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . 0.279 12.4 p 69.24 179.3 0.24 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 128.603 2.761 . . . . 4.25 114.834 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.6 mp -57.4 138.34 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 122.296 1.046 . . . . 2.95 111.245 -171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 94.48 -5.48 70.57 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-N 114.838 -1.074 . . . . 2.08 112.651 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 12.0 ttpp -56.92 139.63 51.13 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.468 1.134 . . . . 4.61 111.326 163.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -86.96 163.5 17.06 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.459 1.504 . . . . 3.49 114.038 -172.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -98.17 148.62 23.39 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.715 2.006 . . . . 1.74 111.034 -169.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -129.03 149.58 50.79 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.487 1.115 . . . . 3.16 112.762 -174.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -147.11 151.55 37.03 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.803 1.038 . . . . 2.51 113.803 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.7 mt -93.86 116.92 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.129 1.371 . . . . 1.13 110.636 -169.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.82 -51.9 4.86 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 117.958 0.345 . . . . 4.75 111.842 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -148.32 113.67 5.58 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.578 1.151 . . . . 4.35 111.057 175.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.99 -166.78 29.4 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 124.934 1.254 . . . . 1.01 111.443 168.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 8.2 t -137.39 142.51 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.27 1.028 . . . . 0.88 109.845 -174.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 28.8 m -126.32 147.46 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.943 1.297 . . . . 0.94 111.9 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -112.65 128.15 56.31 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 126.856 2.063 . . . . 1.37 107.999 176.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 599' ' ' MET . 3.6 p -144.56 151.2 15.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.636 -1.165 . . . . 2.96 108.616 -137.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -119.6 136.64 54.29 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.509 -0.923 . . . . 2.17 108.509 166.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 4.8 p -92.56 128.49 38.43 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.266 1.031 . . . . 2.07 113.432 155.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.58 145.88 32.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.463 1.105 . . . . 3.96 110.934 169.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 76.54 -22.69 2.11 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 114.846 0.698 . . . . 3.43 114.846 -163.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.561 ' CA ' ' HE3' ' A' ' 597' ' ' LYS . 45.3 m-20 -137.17 -138.04 0.15 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 117.545 0.672 . . . . 3.25 110.904 -146.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.561 ' HE3' ' CA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 167.31 9.82 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 125.911 1.684 . . . . 4.17 114.075 -155.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -94.65 121.9 36.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 113.342 -1.754 . . . . 4.56 110.757 162.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 591' ' ' VAL . 57.0 mtm -129.27 178.21 6.6 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 127.419 2.287 . . . . 2.36 113.075 -167.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.61 160.27 18.74 Favored 'General case' 0 N--CA 1.439 -0.998 0 C-N-CA 128.253 2.621 . . . . 3.11 113.138 151.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 12.0 tp -153.71 149.69 27.76 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.61 2.764 . . . . 1.88 108.213 -176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 13.3 t -146.3 -179.57 6.83 Favored 'General case' 0 N--CA 1.482 1.126 0 O-C-N 120.763 -1.211 . . . . 2.52 113.852 -170.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -56.77 150.68 15.66 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.613 1.965 . . . . 2.05 115.912 -166.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.79 10.45 81.18 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.413 1.006 . . . . 1.42 114.71 -173.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 14.9 m -112.48 170.42 8.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 127.772 2.429 . . . . 1.05 111.929 -177.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -149.36 151.17 33.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 115.917 1.821 . . . . 3.62 115.917 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -164.65 -175.17 3.71 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.64 1.976 . . . . 2.01 114.248 -164.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 100.13 -65.8 0.58 Allowed Glycine 0 N--CA 1.471 0.995 0 C-N-CA 125.515 1.531 . . . . 4.13 112.667 172.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -151.72 149.06 28.65 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.951 1.3 . . . . 7.35 110.535 170.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 5.2 mp -131.05 100.2 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.09 0 N-CA-C 107.264 -1.384 . . . . 5.7 107.264 156.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 48.6 t -115.91 1.22 13.3 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.506 1.922 . . . . 6.04 112.055 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.439 HD21 ' CG ' ' A' ' 638' ' ' PHE . 1.2 tm? -64.05 -40.64 96.74 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.582 1.953 . . . . 2.51 113.103 -162.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -131.45 18.7 4.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.521 1.529 . . . . 3.9 111.642 170.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 17.4 p -146.01 166.91 24.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.959 1.303 . . . . 3.79 113.476 -145.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -74.13 148.49 41.72 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.067 1.347 . . . . 12.23 113.257 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -117.32 -135.33 5.42 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 127.261 2.362 . . . . 3.5 114.394 -168.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 57.41 24.22 9.9 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 127.507 2.323 . . . . 3.46 114.065 -172.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -78.95 131.93 36.53 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.651 0.78 . . . . 6.09 112.572 -169.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.8 t -139.22 153.39 47.85 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.709 1.204 . . . . 5.38 110.616 165.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -146.36 145.68 30.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.312 1.445 . . . . 2.23 111.258 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 1.4 m -88.12 99.72 12.4 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.312 1.045 . . . . 2.03 109.38 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -152.11 138.81 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.084 -1.01 . . . . 1.41 112.737 -177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.63 159.88 34.19 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.241 1.816 . . . . 4.68 112.511 178.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -73.9 133.2 43.08 Favored 'General case' 0 CA--C 1.549 0.924 0 O-C-N 121.537 -0.727 . . . . 0.98 111.757 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -75.87 -22.03 56.59 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-O 122.682 1.229 . . . . 2.46 112.467 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.7 t -158.95 177.48 11.1 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 129.261 3.025 . . . . 1.3 107.861 -158.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.57 124.27 20.54 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 119.801 -1.812 . . . . 4.07 109.11 162.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.5 t -134.1 124.69 26.57 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.343 1.457 . . . . 2.79 110.555 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -102.83 123.25 46.13 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.64 1.576 . . . . 4.36 110.486 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 30.9 mt -116.79 175.97 5.33 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.477 2.311 . . . . 1.08 110.992 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -135.18 155.35 50.83 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.37 2.268 . . . . 6.8 109.933 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 43.3 p -139.53 143.67 37.52 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 115.205 1.558 . . . . 1.62 115.205 170.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 4.0 tt -145.66 128.33 16.18 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.809 1.244 . . . . 1.53 111.55 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 28.5 t -79.81 140.31 36.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.246 1.819 . . . . 2.29 114.601 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.421 ' HB ' HD22 ' A' ' 612' ' ' LEU . 1.4 m -68.92 -24.43 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-O 118.366 -0.826 . . . . 1.87 112.092 174.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -62.03 -46.97 86.82 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.538 1.063 . . . . 2.49 109.893 173.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -74.13 -19.54 60.54 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.218 0.821 . . . . 2.4 113.218 -175.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.439 ' CG ' HD21 ' A' ' 612' ' ' LEU . 4.6 t80 -73.62 -52.65 12.67 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.07 1.748 . . . . 2.66 111.98 163.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -64.61 -22.89 67.09 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 121.097 -1.002 . . . . 1.93 111.601 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -67.92 -55.41 12.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.274 1.83 . . . . 3.26 113.051 170.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.2 p -68.93 -26.44 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.642 1.177 . . . . 1.2 112.621 -174.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -20.6 45.3 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.303 0.853 . . . . 2.74 113.303 171.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -72.87 -11.09 60.46 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.532 -1.355 . . . . 3.4 113.266 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -92.95 -14.45 27.5 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.07 -1.644 . . . . 3.15 113.926 176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -129.37 69.89 81.48 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 127.34 2.256 . . . . 2.19 111.701 -173.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -56.27 -23.49 46.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.281 2.654 . . . . 1.64 114.68 -178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -66.68 -30.79 71.12 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.886 1.221 . . . . 2.81 112.587 173.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 69.8 mmm -75.44 -22.29 57.46 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.309 -0.87 . . . . 1.79 112.214 -174.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -59.11 -55.17 38.43 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 118.659 0.663 . . . . 5.71 109.332 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -41.76 83.78 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.677 0.791 . . . . 5.91 111.768 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.19 42.31 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.608 1.563 . . . . 3.01 114.704 175.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -92.59 -34.2 14.12 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.072 1.349 . . . . 3.86 112.886 166.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -65.14 -26.23 68.09 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.03 -1.668 . . . . 4.99 113.803 175.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 14.6 t -77.18 -20.23 55.7 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.673 1.589 . . . . 5.67 113.354 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -101.48 -32.95 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 126.508 1.923 . . . . 5.12 111.644 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -45.24 -41.56 8.58 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.993 1.717 . . . . 5.85 114.299 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -12.34 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 114.266 1.21 . . . . 8.65 114.266 -175.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -114.13 -29.36 7.0 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.957 1.703 . . . . 7.03 112.931 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 65.4 ttt-85 -60.93 -24.15 65.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.802 2.041 . . . . 6.14 115.932 -166.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 5.8 tt -51.95 -57.23 10.05 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.416 1.486 . . . . 8.56 113.607 -170.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -88.63 2.08 53.84 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.791 1.237 . . . . 10.95 113.712 -173.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -80.41 -25.71 38.87 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.659 1.355 . . . . 18.3 114.659 -169.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 12.5 mm 48.87 138.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 129.972 3.309 . . . . 16.87 118.199 149.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -73.13 21.59 1.03 Allowed Glycine 0 CA--C 1.538 1.521 0 O-C-N 119.914 -1.742 . . . . 21.0 115.921 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -72.32 133.4 44.97 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.663 1.585 . . . . 22.48 112.522 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 45.9 mtpt -136.06 164.86 27.03 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.962 1.705 . . . . 30.25 111.265 -177.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -64.62 -18.73 65.19 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.656 0.782 . . . . 33.18 112.088 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 51.9 p -87.94 -42.68 12.31 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 127.274 2.23 . . . . 31.85 115.295 170.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 46.1 pt -144.8 153.86 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 114.962 1.467 . . . . 31.89 114.962 -161.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 95.5 mt -137.76 165.92 25.24 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 128.723 2.809 . . . . 29.88 109.283 171.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.9 tp -147.23 81.08 1.53 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.633 1.346 . . . . 31.03 114.633 175.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 . . . . . 0 C--O 1.257 1.489 0 C-N-CA 127.699 2.4 . . . . 34.61 115.578 153.811 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 115.298 1.592 . . . . 8.12 115.298 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 20.3 p -48.64 -34.09 11.14 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.678 1.362 . . . . 4.0 114.678 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -67.07 -33.07 74.7 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.725 1.148 . . . . 6.07 113.954 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 537' ' ' LYS 0.263 0.0 OUTLIER -86.4 -31.39 21.48 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.887 1.069 . . . . 6.79 113.887 167.295 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.14 -41.12 62.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.157 0.983 . . . . 2.51 112.036 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.459 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.4 OUTLIER -68.06 -42.1 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.298 1.039 . . . . 1.29 110.703 173.754 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -65.3 -13.83 59.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.752 1.221 . . . . 1.82 114.165 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 37.8 m -94.38 -6.03 45.1 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.778 1.631 . . . . 3.38 113.057 -173.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 61.7 mtp -69.76 151.16 96.49 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.881 1.272 . . . . 3.44 111.537 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -73.67 -17.43 23.21 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.692 2.928 . . . . 1.95 112.709 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.08 -20.64 64.09 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.206 2.202 . . . . 2.87 112.099 166.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . 0.459 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 39.6 m-85 -112.48 13.87 20.19 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.537 2.335 . . . . 2.69 112.999 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -50.2 -32.96 17.76 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.278 1.831 . . . . 1.52 114.273 -177.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.72 4.13 12.3 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.722 2.009 . . . . 2.69 111.974 -171.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.453 ' HB1' ' CG1' ' A' ' 553' ' ' VAL . . . -63.5 132.2 50.55 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.057 1.132 . . . . 1.32 114.057 -170.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.31 129.25 92.95 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.442 1.097 . . . . 1.85 110.125 171.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -60.76 -15.4 37.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.677 2.918 . . . . 1.25 114.33 -173.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.52 -37.13 13.32 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.688 1.195 . . . . 1.87 110.732 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -60.94 -49.18 78.5 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.913 1.285 . . . . 1.86 110.524 171.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.453 ' CG1' ' HB1' ' A' ' 548' ' ' ALA . 4.6 m -64.36 -35.91 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 121.977 -0.452 . . . . 1.73 111.691 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 53.0 m -72.43 -39.39 67.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.346 1.458 . . . . 1.74 111.787 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.73 -19.2 63.71 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.37 0.532 . . . . 1.17 112.05 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 15.4 ttm -77.96 -25.39 48.19 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.091 1.145 . . . . 1.12 114.091 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 560' ' ' LEU . 15.7 mt -81.79 -9.68 59.55 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.06 1.133 . . . . 1.47 114.06 -165.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 35.3 p -40.49 -43.13 1.78 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.154 2.182 . . . . 2.19 115.364 177.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -111.46 7.2 20.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.555 1.542 . . . . 3.21 114.97 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 557' ' ' LEU . 1.4 mt -61.88 139.8 58.34 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.079 -1.013 . . . . 2.76 112.064 -167.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -130.03 138.65 50.88 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.272 1.029 . . . . 3.03 112.884 -173.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.94 153.55 24.37 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.258 1.023 . . . . 2.74 112.282 177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -142.02 164.51 29.99 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.559 1.544 . . . . 3.34 111.737 -174.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 20.3 t -131.34 142.45 43.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.0 1.32 . . . . 0.95 111.359 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -119.66 141.33 49.45 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.407 1.083 . . . . 2.15 110.664 166.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -83.87 167.34 28.62 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.642 1.177 . . . . 3.14 111.193 176.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.91 133.52 58.49 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 122.314 2.01 . . . . 1.03 112.831 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.89 -2.45 79.74 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 126.064 1.792 . . . . 1.11 113.649 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -92.71 128.49 38.58 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.903 1.281 . . . . 2.38 111.98 -168.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -73.34 125.95 29.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.773 0.829 . . . . 2.59 111.041 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.6 pt -90.14 -23.03 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 113.823 1.046 . . . . 1.14 113.823 -170.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 51.7 mt -133.71 141.35 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 126.888 2.075 . . . . 1.57 110.498 -170.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -152.49 116.23 4.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.032 1.733 . . . . 7.83 108.923 168.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -82.19 173.54 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.006 1.323 . . . . 6.35 114.101 -175.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 163.73 -0.74 0.05 OUTLIER Glycine 0 CA--C 1.536 1.371 0 N-CA-C 115.769 1.068 . . . . 3.59 115.769 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -144.91 154.18 42.34 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.333 1.066 . . . . 2.69 113.614 -171.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 24.8 mt -82.33 134.62 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 124.845 1.258 . . . . 3.02 110.212 171.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 85.95 27.5 31.28 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 123.759 0.695 . . . . 1.84 113.363 175.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -69.97 173.76 6.08 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.279 1.432 . . . . 3.97 111.497 -178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.6 mmtt -85.89 166.82 15.67 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.506 1.123 . . . . 4.94 112.084 -167.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 3.3 ptm -109.26 155.29 21.3 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.5 1.296 . . . . 2.58 114.5 167.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -139.54 144.83 38.05 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.173 1.389 . . . . 2.99 110.913 -175.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -146.44 141.09 26.78 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.134 -0.979 . . . . 2.67 111.363 -174.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 605' ' ' SER . 15.7 mt -88.54 123.1 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 O-C-N 121.506 -0.746 . . . . 0.92 111.284 -161.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -93.9 -50.2 5.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.089 0.774 . . . . 2.6 113.089 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -155.49 100.89 2.15 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.827 0.851 . . . . 3.99 111.756 -176.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.53 -161.77 30.73 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 124.653 1.121 . . . . 0.95 111.691 170.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 84.2 t -134.83 143.39 37.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 C-N-CA 124.771 1.228 . . . . 0.99 109.024 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.08 144.32 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.28 1.032 . . . . 0.98 110.576 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 13.0 m -99.24 114.64 27.56 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.692 0.797 . . . . 1.54 110.475 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 4.4 t -79.0 148.54 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.46 1.504 . . . . 3.46 108.432 162.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.87 147.55 40.94 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.369 1.068 . . . . 1.97 109.332 164.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.14 137.13 52.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.016 0.826 . . . . 3.37 111.485 162.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . 0.476 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.0 OUTLIER -53.47 -43.95 68.56 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 117.7 2.482 . . . . 6.39 117.7 -162.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.0 -4.14 90.14 Favored Glycine 0 N--CA 1.47 0.941 0 C-N-CA 125.315 1.436 . . . . 4.87 114.278 174.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.19 -157.51 0.82 Allowed 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.805 0.842 . . . . 4.48 111.728 -144.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.56 176.82 5.2 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 127.675 2.39 . . . . 3.62 111.469 -173.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -76.16 158.58 31.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.705 -1.134 . . . . 4.42 112.89 164.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.2 mtm -146.19 126.9 14.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.839 1.656 . . . . 2.39 111.481 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.61 131.73 34.95 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.65 0.981 . . . . 2.61 113.65 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.56 159.44 26.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.163 2.185 . . . . 0.98 110.893 170.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 73.9 p -145.31 -179.7 6.81 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.065 1.346 . . . . 1.74 113.458 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.89 132.42 14.92 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.798 1.036 . . . . 1.95 113.798 176.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 89.25 -12.82 65.26 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.066 1.317 . . . . 1.16 115.799 -175.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.457 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.5 m -72.66 160.13 32.73 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.023 1.412 . . . . 1.01 111.429 170.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.62 138.51 21.07 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.39 1.076 . . . . 5.78 112.882 -169.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.63 -178.48 6.89 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.963 1.305 . . . . 2.52 114.254 178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 119.21 78.52 0.58 Allowed Glycine 0 N--CA 1.474 1.209 0 C-N-CA 125.691 1.615 . . . . 3.78 112.034 -172.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 43.26 -142.77 0.12 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 126.509 1.923 . . . . 7.94 112.398 -172.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 91.3 mt -109.8 -57.33 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.686 1.194 . . . . 5.73 107.959 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 3.3 t 57.73 -153.13 0.38 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 126.777 2.031 . . . . 5.4 115.261 166.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.776 HD23 HG22 ' A' ' 635' ' ' VAL . 47.3 mt 55.41 -74.1 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 129.917 3.287 . . . . 2.01 112.946 -167.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . 0.665 ' H ' HD13 ' A' ' 613' ' ' LEU . 0.0 OUTLIER -104.67 -12.32 16.44 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.518 2.327 . . . . 3.37 114.404 -176.378 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 10.5 t -110.07 156.21 20.85 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.357 0.663 . . . . 2.98 111.919 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.73 150.72 35.93 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.949 1.3 . . . . 7.03 113.988 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.99 136.43 4.69 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 127.948 2.689 . . . . 2.36 110.025 -172.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 88.3 mtm-85 -72.15 146.12 47.65 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.34 1.056 . . . . 5.02 112.93 -167.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -131.23 173.28 11.2 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 127.689 2.396 . . . . 5.64 109.663 178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 22.8 m -143.01 132.99 24.18 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 119.107 0.867 . . . . 3.13 112.753 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -127.04 154.85 44.12 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.702 2.001 . . . . 1.53 113.077 174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 70.5 m -127.93 102.38 6.74 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.766 1.626 . . . . 1.93 109.274 166.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 6.9 p -148.64 138.54 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.474 -0.766 . . . . 1.09 112.611 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -138.15 156.88 47.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.255 1.422 . . . . 3.72 113.385 -172.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.25 127.72 33.82 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.654 0.781 . . . . 0.99 110.468 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -79.29 -13.74 59.46 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.94 1.352 . . . . 2.94 112.904 -177.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 5.3 t -164.14 174.48 11.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 129.545 3.138 . . . . 1.12 107.007 -163.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.05 121.82 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.941 -1.1 . . . . 3.41 108.777 165.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 7.6 t -132.29 124.95 29.86 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.925 0.89 . . . . 2.76 111.523 -174.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 13.3 mmm-85 -83.42 113.96 21.12 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.714 2.006 . . . . 2.92 108.552 172.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 34.2 mt -108.01 162.31 14.15 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.872 1.269 . . . . 1.07 111.228 173.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.16 139.68 53.03 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.107 1.363 . . . . 7.47 109.143 170.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 48.8 m -122.3 132.42 54.4 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.79 1.236 . . . . 2.4 111.236 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 3.5 tt -132.7 116.39 16.55 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.025 0.93 . . . . 1.35 110.458 -175.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 6.0 p -64.17 119.08 9.53 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.54 0.736 . . . . 2.78 111.768 174.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -54.7 -39.94 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 122.645 1.212 . . . . 2.47 112.19 -174.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -75.89 -24.94 55.68 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.362 -0.836 . . . . 2.59 111.224 -167.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -79.47 -19.62 49.35 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.095 0.958 . . . . 2.44 112.263 175.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.96 -47.97 48.48 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.191 1.796 . . . . 2.4 109.605 163.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -61.65 -25.81 67.61 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 121.083 -1.011 . . . . 2.33 113.06 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.91 -47.29 66.14 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.811 1.244 . . . . 3.52 112.584 173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 5.1 p -73.1 -25.93 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.392 1.077 . . . . 1.15 112.049 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.84 -34.71 9.11 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 114.597 1.332 . . . . 3.01 114.597 164.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -81.74 -16.4 51.24 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.35 -0.844 . . . . 4.39 112.736 -178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.22 -18.99 54.68 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.626 -1.296 . . . . 3.31 113.662 176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -128.86 76.43 79.04 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.71 1.604 . . . . 2.3 109.944 -175.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -57.94 -14.18 17.61 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 124.191 3.26 . . . . 1.48 116.395 -175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.1 ttp -70.99 -51.26 26.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.175 1.352 . . . . 1.74 111.042 164.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -29.63 69.55 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.755 0.822 . . . . 1.72 111.61 -176.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -45.87 78.66 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.632 1.173 . . . . 4.56 112.122 169.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -63.29 -43.44 97.88 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.03 1.332 . . . . 5.38 111.821 -176.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -51.33 -25.75 6.44 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.612 1.565 . . . . 1.72 115.045 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -95.1 -37.99 10.83 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.845 1.424 . . . . 2.16 114.845 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -73.78 -17.78 61.05 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 119.635 -1.916 . . . . 3.98 113.694 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 5.2 t -77.31 -20.99 54.18 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.684 1.194 . . . . 2.53 112.737 176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.2 p -99.22 -37.13 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.652 1.981 . . . . 2.56 112.137 174.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -53.98 -36.55 63.03 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.447 0.906 . . . . 2.86 113.447 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -59.81 -21.16 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 N-CA-C 114.258 1.207 . . . . 5.05 114.258 177.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -101.98 -32.59 10.1 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.603 1.561 . . . . 5.7 112.332 171.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.0 tpt85 -61.74 -34.02 75.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.86 1.264 . . . . 5.68 113.747 -176.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.68 -13.42 59.91 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.61 1.564 . . . . 5.98 112.425 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 t70 46.11 -129.23 1.32 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.932 2.093 . . . . 7.85 113.725 172.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -91.31 -1.81 57.55 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.225 1.565 . . . . 12.16 115.225 169.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . 0.404 ' H ' HG13 ' A' ' 663' ' ' ILE . 2.9 pp -106.84 10.56 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.672 1.989 . . . . 14.63 115.679 -167.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -60.39 -32.4 77.22 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-O 118.459 -1.19 . . . . 18.28 114.972 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 47.65 78.84 0.07 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 127.42 2.288 . . . . 20.26 114.241 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -53.87 137.95 37.43 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.637 1.575 . . . . 26.31 113.236 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -105.21 133.5 49.88 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.411 1.484 . . . . 27.39 111.167 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.1 m -134.79 -173.92 3.44 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.776 1.23 . . . . 29.79 112.202 -175.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 44.8 pt -60.69 159.59 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.837 1.655 . . . . 34.27 115.094 -172.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.37 43.77 1.44 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.725 2.01 . . . . 36.13 110.882 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.463 HD12 ' H ' ' A' ' 672' ' ' HIS . 28.7 tp -149.59 157.96 43.74 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 122.684 1.231 . . . . 39.75 112.916 -170.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.463 ' H ' HD12 ' A' ' 671' ' ' LEU . 56.1 t-80 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.62 2.768 . . . . 42.94 114.293 -177.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.463 -0.569 . . . . 7.85 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -104.24 -30.71 9.99 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.596 1.158 . . . . 3.33 112.583 175.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -62.03 -34.19 75.76 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.347 0.976 . . . . 5.64 112.864 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -58.42 -22.97 56.08 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.152 1.381 . . . . 3.71 114.402 174.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.41 -45.13 9.68 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.811 0.732 . . . . 2.44 111.541 176.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -39.22 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-N 118.75 0.705 . . . . 1.84 111.216 175.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.3 -1.78 9.04 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.784 1.634 . . . . 2.12 114.877 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 36.9 p -83.9 -21.6 31.85 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.263 -0.898 . . . . 4.52 111.749 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 99.1 mtp -68.27 136.77 91.35 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.433 1.493 . . . . 2.42 110.561 169.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.72 -31.94 78.61 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.008 2.472 . . . . 2.46 112.096 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -53.05 -31.39 41.24 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.68 1.992 . . . . 2.81 113.427 172.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -106.02 -7.1 18.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.168 1.787 . . . . 2.62 113.663 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -61.29 -36.26 79.59 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 120.021 -1.675 . . . . 1.82 114.041 -171.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . 0.482 ' ND2' ' H ' ' A' ' 547' ' ' ASN . 5.1 p30 -88.49 -1.17 57.9 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.782 2.433 . . . . 4.68 113.705 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -68.13 154.4 41.76 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.944 1.461 . . . . 1.27 114.944 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -71.15 127.69 91.24 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.871 0.869 . . . . 2.09 111.332 169.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -63.42 -14.52 42.77 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.724 2.949 . . . . 1.28 114.755 -171.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -90.63 -41.1 11.52 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.196 0.998 . . . . 2.26 110.42 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -56.93 -48.96 77.06 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.632 1.173 . . . . 2.34 111.558 172.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 6.1 m -64.86 -31.37 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 113.211 0.819 . . . . 1.91 113.211 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 97.0 m -83.18 -41.2 18.74 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 127.327 2.251 . . . . 1.32 111.397 -177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -59.7 -19.53 50.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.233 0.827 . . . . 0.77 113.233 -177.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . 0.549 ' HB3' HG11 ' A' ' 641' ' ' VAL . 9.0 ptp -90.57 -9.87 45.53 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.459 1.651 . . . . 1.77 115.459 174.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 22.2 mt -84.76 -14.94 46.7 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.23 -0.919 . . . . 1.57 112.6 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 37.0 p -57.5 -28.37 63.37 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.76 1.624 . . . . 1.88 114.567 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.6 ptmt -108.3 -2.7 19.01 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 127.782 2.433 . . . . 2.62 115.485 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.408 HD13 ' HG ' ' A' ' 633' ' ' LEU . 21.3 tp -61.45 149.75 37.65 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.226 1.81 . . . . 2.58 114.135 -159.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.68 133.71 40.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.513 1.301 . . . . 1.97 114.513 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.14 136.9 46.2 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 127.168 2.187 . . . . 2.82 108.57 174.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -138.73 152.63 48.14 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.038 0.755 . . . . 2.67 113.038 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.575 HG11 ' CE1' ' A' ' 627' ' ' TYR . 45.3 t -119.89 149.0 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.055 0.942 . . . . 0.83 111.566 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -126.7 151.52 48.01 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.174 1.39 . . . . 2.15 111.33 167.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -90.88 165.64 21.47 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.445 1.498 . . . . 2.81 111.29 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -59.62 131.43 40.2 Favored 'Trans proline' 0 CA--C 1.539 0.764 0 C-N-CA 122.544 2.162 . . . . 1.21 112.457 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.41 -7.02 61.55 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 125.446 1.498 . . . . 1.24 113.765 170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -96.26 144.27 26.6 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.725 1.262 . . . . 1.98 112.425 -171.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -72.73 121.75 20.37 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.413 1.085 . . . . 2.78 111.192 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.412 HD11 HG13 ' A' ' 622' ' ' VAL . 2.5 pp -86.46 -18.18 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 115.626 1.713 . . . . 1.42 115.626 -167.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 5.6 mt -113.72 160.05 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 N-CA-C 114.934 1.457 . . . . 2.56 114.934 -172.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 81.7 mtt85 -133.48 176.08 8.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.972 2.109 . . . . 10.42 112.131 174.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -41.69 152.17 0.07 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 128.054 2.542 . . . . 5.62 116.855 -172.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -121.55 30.02 5.49 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.734 1.635 . . . . 5.71 112.606 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -54.52 152.73 6.38 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.212 1.005 . . . . 3.77 110.536 164.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.94 125.12 22.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.811 -0.556 . . . . 2.49 109.518 -157.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 100.78 -2.05 55.59 Favored Glycine 0 CA--C 1.54 1.617 0 C-N-CA 125.505 1.526 . . . . 1.94 114.126 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -68.06 169.76 9.58 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 118.418 1.109 . . . . 6.1 113.786 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm -84.92 168.19 15.24 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.537 1.935 . . . . 3.43 114.524 -166.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -112.65 148.05 35.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.416 1.886 . . . . 1.83 111.707 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -133.93 142.87 47.9 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.604 1.162 . . . . 2.38 113.201 -171.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 38.4 p90 -149.22 160.66 43.18 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.051 0.94 . . . . 2.52 113.165 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 605' ' ' SER . 20.6 mt -98.21 113.48 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.014 0.926 . . . . 0.74 111.575 -164.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -76.75 -54.79 6.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.539 0.736 . . . . 2.8 110.452 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -159.44 119.33 3.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.66 0.784 . . . . 2.43 111.54 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.39 -156.9 26.95 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 124.899 1.238 . . . . 1.03 111.076 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.6 t -141.55 142.86 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.8 1.64 . . . . 1.1 109.856 178.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 23.6 m -128.42 150.66 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.973 1.309 . . . . 1.01 111.314 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.0 m -116.81 124.35 49.35 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.706 2.002 . . . . 1.68 108.834 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 3.2 p -144.27 152.5 15.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.605 -1.179 . . . . 3.05 108.479 -139.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -120.49 132.56 55.26 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 118.55 -0.738 . . . . 1.61 109.494 165.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . 0.292 0.8 OUTLIER -92.26 146.93 23.32 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 113.364 0.875 . . . . 2.49 113.364 166.214 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.74 -19.19 38.4 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 116.746 2.128 . . . . 4.5 116.746 -148.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -91.06 -10.57 62.43 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.264 1.411 . . . . 3.86 113.507 160.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.22 -154.8 0.61 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 121.651 0.739 . . . . 3.98 111.492 -141.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.403 ' H ' ' HE2' ' A' ' 597' ' ' LYS . 0.5 OUTLIER -102.74 175.19 5.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.337 1.855 . . . . 3.39 112.125 177.047 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -58.78 146.31 37.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.031 -0.986 . . . . 3.23 112.458 165.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.6 mtm -132.86 178.35 6.94 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.253 1.421 . . . . 2.12 111.999 165.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -100.34 159.88 14.78 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.624 1.57 . . . . 2.06 113.874 136.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.3 mp -126.44 150.88 48.4 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.459 2.304 . . . . 1.19 109.966 167.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 36.5 p -123.65 174.08 7.68 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.195 1.798 . . . . 1.62 112.342 -174.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -58.49 140.95 53.19 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.597 0.962 . . . . 2.02 113.597 -177.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.01 -6.7 73.93 Favored Glycine 0 CA--C 1.538 1.498 0 C-N-CA 124.622 1.106 . . . . 1.16 115.37 -170.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.496 ' HB2' HD12 ' A' ' 584' ' ' ILE . 47.9 m -74.24 163.23 28.08 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.486 1.143 . . . . 1.07 111.551 167.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -142.13 163.76 31.99 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.605 0.965 . . . . 3.43 113.605 178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.84 162.62 15.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 117.443 2.386 . . . . 2.36 117.443 -165.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 84.82 0.07 89.13 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-N 113.94 -1.482 . . . . 3.32 116.768 149.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 58.86 -3.52 0.08 Allowed 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.562 1.945 . . . . 7.48 115.356 -172.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 11.3 mt -56.84 108.54 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 127.053 2.141 . . . . 7.63 111.824 -173.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 32.7 t -90.12 146.12 24.54 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.867 1.667 . . . . 6.53 109.592 165.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.482 HD22 ' CG ' ' A' ' 638' ' ' PHE . 4.0 mp -73.25 -5.43 39.4 Favored 'General case' 0 N--CA 1.477 0.875 0 O-C-N 120.1 -1.625 . . . . 2.55 113.204 174.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.8 mp -115.13 20.79 14.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 127.71 2.404 . . . . 3.51 111.082 169.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 4.8 t -63.38 164.62 8.83 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.062 0.945 . . . . 3.2 112.649 171.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 31.1 ttp85 -126.42 132.36 51.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.908 1.683 . . . . 10.6 110.397 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 67.68 -161.66 48.68 Favored Glycine 0 CA--C 1.538 1.526 0 N-CA-C 115.653 1.021 . . . . 2.45 115.653 176.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -56.05 152.54 10.29 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 126.527 1.931 . . . . 4.26 112.992 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -130.64 155.18 46.99 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 127.057 2.143 . . . . 4.9 109.936 167.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 6.4 t -154.92 150.86 27.87 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 119.212 0.915 . . . . 3.24 111.795 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -149.08 158.28 44.06 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.9 0.88 . . . . 1.8 113.252 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 60.6 p -130.35 88.21 2.61 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.797 1.639 . . . . 3.07 112.003 -170.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 571' ' ' ILE . 1.6 p -156.17 147.76 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 N-CA-C 114.437 1.273 . . . . 1.03 114.437 -172.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -132.74 161.89 32.88 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.925 2.09 . . . . 4.74 112.379 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -77.64 138.63 39.21 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 120.537 -1.352 . . . . 0.97 112.548 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -79.33 -27.12 42.08 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 122.479 1.133 . . . . 2.59 111.995 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 6.4 t -156.15 173.19 17.19 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.11 2.564 . . . . 1.14 109.175 -161.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.575 ' CE1' HG11 ' A' ' 564' ' ' VAL . 20.6 t80 -69.62 104.64 2.43 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.726 -1.234 . . . . 3.89 108.776 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 14.6 t -115.75 135.04 54.41 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.86 1.264 . . . . 2.42 112.218 -165.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 -88.61 123.48 33.13 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.149 1.78 . . . . 4.72 109.835 172.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 33.8 mt -120.27 168.83 10.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.942 2.097 . . . . 0.77 111.536 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -128.22 145.48 51.02 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 125.654 1.582 . . . . 7.14 109.907 174.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 28.5 t -131.56 114.12 14.47 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.205 1.002 . . . . 1.79 111.767 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.408 ' HG ' HD13 ' A' ' 560' ' ' LEU . 3.8 tt -123.55 127.0 47.69 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.987 1.315 . . . . 1.63 110.821 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 50.8 p -88.72 133.46 34.22 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.278 1.031 . . . . 2.0 112.548 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.462 ' HB ' HD23 ' A' ' 612' ' ' LEU . 2.4 m -66.81 -21.87 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 121.291 -0.881 . . . . 1.74 111.453 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -46.8 -49.16 20.35 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.286 1.434 . . . . 2.42 111.869 169.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . 0.577 ' O ' HG12 ' A' ' 641' ' ' VAL . 24.6 m120 -80.13 -34.61 37.61 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 114.289 1.218 . . . . 2.1 114.289 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.482 ' CG ' HD22 ' A' ' 612' ' ' LEU . 33.0 t80 -52.7 -41.18 63.67 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 120.682 1.583 . . . . 2.75 112.504 168.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -76.04 -24.38 55.17 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.161 0.985 . . . . 1.83 113.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -75.25 -48.8 21.63 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.35 1.46 . . . . 3.4 114.022 176.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . 0.577 HG12 ' O ' ' A' ' 637' ' ' ASN . 4.7 p -70.23 -28.18 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 126.781 2.033 . . . . 1.39 113.23 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.72 -39.89 52.95 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.206 1.187 . . . . 2.16 114.206 -174.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -11.28 60.82 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.439 1.644 . . . . 5.7 115.439 -176.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -75.09 -18.27 60.3 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.767 1.227 . . . . 2.31 112.611 169.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -130.83 62.91 68.07 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.829 2.051 . . . . 2.34 110.096 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -58.68 -22.64 61.93 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.677 2.918 . . . . 1.52 115.037 -168.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 47.4 ttp -53.59 -44.46 69.41 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.527 1.058 . . . . 1.65 111.858 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 77.1 mmm -75.15 -25.14 58.14 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.57 -0.706 . . . . 1.6 112.287 176.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -52.1 49.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.302 0.955 . . . . 4.45 110.308 173.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -33.81 72.39 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.445 0.906 . . . . 4.34 113.445 174.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.04 67.64 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.761 1.023 . . . . 2.1 113.761 176.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -94.85 -27.97 15.47 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.993 1.317 . . . . 2.65 114.503 170.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.52 -37.74 80.29 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.076 -1.64 . . . . 3.65 111.735 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -69.36 -27.44 65.34 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.119 0.967 . . . . 3.76 113.09 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.38 -27.86 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 126.594 1.958 . . . . 3.57 112.241 -174.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.07 -18.04 59.42 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.186 1.551 . . . . 3.84 115.186 -178.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.8 tt -98.0 -10.09 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 126.026 1.731 . . . . 5.86 113.487 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -107.23 -38.29 6.02 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.057 1.343 . . . . 4.82 112.558 -174.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -72.57 -1.19 15.09 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.059 2.544 . . . . 5.93 115.764 -177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -75.02 -47.35 29.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.716 1.606 . . . . 6.09 112.092 -167.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 8.2 t70 63.47 177.35 0.16 Allowed 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.54 2.336 . . . . 6.96 116.435 169.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -90.26 -44.54 9.65 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.705 1.602 . . . . 11.31 112.508 -159.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 41.9 mm 66.03 -48.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 128.033 2.533 . . . . 11.27 117.793 164.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 146.17 60.18 0.02 OUTLIER Glycine 0 N--CA 1.469 0.88 0 C-N-CA 124.687 1.137 . . . . 15.36 110.542 -170.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -144.77 138.02 26.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.413 1.485 . . . . 15.81 110.765 -153.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -78.4 -23.91 46.52 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.483 1.29 . . . . 24.84 114.483 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -68.44 136.01 52.6 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.342 1.057 . . . . 19.75 111.286 163.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 25.7 p -86.3 -52.74 5.44 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.656 1.583 . . . . 21.84 112.867 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.7 pt -146.78 160.29 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 125.03 1.332 . . . . 25.44 112.885 -166.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -131.9 12.57 4.79 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.358 1.463 . . . . 24.34 113.523 168.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.409 HD12 ' H ' ' A' ' 672' ' ' HIS . 25.0 tp -133.92 169.17 17.49 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.815 1.646 . . . . 27.27 111.106 -177.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.409 ' H ' HD12 ' A' ' 671' ' ' LEU . 36.9 t-80 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 128.342 2.657 . . . . 33.13 115.311 -172.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 CA--C 1.555 1.169 0 N-CA-C 108.988 -0.745 . . . . 5.89 108.988 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 41.0 t -52.32 -23.77 6.41 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.588 1.555 . . . . 3.35 113.856 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -48.37 -28.5 3.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 115.38 1.622 . . . . 4.79 115.38 171.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -55.32 -38.14 68.31 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 119.844 1.202 . . . . 4.64 113.38 170.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 81.9 mt -84.04 -44.34 14.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.838 1.255 . . . . 2.96 111.833 -164.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.414 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.3 OUTLIER -63.48 -36.95 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 121.713 -0.617 . . . . 1.41 110.383 169.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -71.71 1.0 7.47 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.963 1.468 . . . . 2.03 114.963 171.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 22.8 t -77.06 -27.33 54.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.157 0.89 . . . . 3.91 110.879 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 14.6 ttt -80.45 136.81 52.21 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.371 1.868 . . . . 2.55 110.642 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.87 -19.78 52.26 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.655 2.236 . . . . 1.74 113.077 -173.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -60.29 -27.71 67.5 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.341 1.456 . . . . 2.68 112.862 169.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . 0.414 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 93.7 m-85 -108.79 1.02 20.71 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.372 1.869 . . . . 2.56 114.153 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.16 88.6 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.436 -1.415 . . . . 2.17 113.162 -170.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -111.85 18.35 18.95 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 128.43 2.692 . . . . 3.77 110.513 -168.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -79.97 163.29 24.38 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.761 2.024 . . . . 1.25 114.144 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -68.37 123.24 87.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.033 1.333 . . . . 2.09 109.861 166.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -64.0 -14.23 42.17 Favored 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 123.967 3.111 . . . . 1.44 114.487 -171.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -91.06 -41.77 10.88 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.589 1.156 . . . . 2.43 109.348 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -57.45 -48.5 79.01 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.36 1.064 . . . . 2.21 111.918 173.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.13 -33.32 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-O 121.573 0.701 . . . . 1.78 112.113 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -82.42 -39.93 21.95 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 126.623 1.969 . . . . 1.36 112.945 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -66.83 -19.95 65.84 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.036 -1.04 . . . . 0.87 111.637 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.1 ttm -67.92 -21.84 65.1 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.338 1.455 . . . . 0.84 113.444 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 27.3 mt -86.64 -15.75 38.75 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.023 0.929 . . . . 0.89 113.421 -171.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 10.2 t -50.02 -40.57 45.15 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.043 1.337 . . . . 2.56 114.375 -167.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -106.21 1.41 26.04 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.414 2.286 . . . . 2.71 114.348 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.455 HD13 ' HG ' ' A' ' 633' ' ' LEU . 25.4 tp -63.35 150.05 44.34 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.041 1.336 . . . . 2.28 111.512 -165.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.04 131.56 55.74 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.699 1.0 . . . . 2.68 113.699 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -93.09 149.98 20.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.544 -1.207 . . . . 2.87 110.16 166.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -148.16 164.47 33.83 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.041 0.937 . . . . 4.01 111.803 -173.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 57.3 t -126.2 152.21 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.53 -1.356 . . . . 0.97 113.191 -174.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -134.36 147.34 50.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.011 0.925 . . . . 2.07 111.171 161.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -85.61 163.68 43.23 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 124.591 1.156 . . . . 2.7 111.221 177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.95 142.56 98.75 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 122.337 2.025 . . . . 1.11 114.616 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 86.85 12.07 69.38 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.303 1.43 . . . . 1.29 113.159 165.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -118.48 143.11 46.94 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.227 1.411 . . . . 2.72 112.118 -174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -78.18 126.6 31.03 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.572 0.749 . . . . 2.8 110.707 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.8 pt -85.71 -30.04 6.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 112.945 0.72 . . . . 1.05 112.945 -171.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 77.5 mt -136.44 146.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 127.272 2.229 . . . . 1.8 110.407 -170.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -115.64 149.41 38.36 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.459 1.504 . . . . 6.92 110.047 159.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -92.1 140.05 30.03 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.972 -1.08 . . . . 4.97 112.18 161.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 175.29 9.72 0.02 OUTLIER Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.127 -1.374 . . . . 3.42 115.423 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.2 t -151.02 151.04 31.48 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 120.784 2.292 . . . . 2.86 114.428 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.93 144.72 13.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-N 114.21 -1.359 . . . . 2.42 108.957 160.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.53 48.15 6.04 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 121.632 -0.668 . . . . 2.27 113.736 171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 8.1 tptm -65.06 163.13 15.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.187 1.395 . . . . 5.15 113.126 -176.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.5 mmtm -85.31 176.48 8.28 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.198 0.999 . . . . 4.77 110.425 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.16 135.28 46.81 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.467 0.707 . . . . 2.33 110.136 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.69 142.18 41.08 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.245 1.018 . . . . 3.41 110.414 -176.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -151.72 155.21 37.84 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.647 -1.283 . . . . 2.9 114.202 -171.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.54 HD12 ' HB2' ' A' ' 605' ' ' SER . 6.4 mt -95.95 114.41 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.458 1.103 . . . . 0.85 110.442 -168.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -94.63 -47.95 6.29 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.806 0.842 . . . . 2.73 112.075 -177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -148.34 105.7 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.339 0.518 . . . . 2.38 110.506 163.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 172.24 173.79 39.17 Favored Glycine 0 CA--C 1.525 0.675 0 O-C-N 120.897 -1.127 . . . . 0.89 112.234 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 44.3 t -131.53 144.44 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.084 1.353 . . . . 0.89 108.506 173.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.51 147.46 33.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.487 1.515 . . . . 0.68 111.007 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 27.5 m -95.4 111.16 23.09 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 121.338 0.59 . . . . 1.26 110.861 157.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.8 t -78.75 147.16 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.915 1.686 . . . . 3.16 109.303 170.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.57 143.47 42.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.704 1.202 . . . . 2.1 109.292 163.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -114.6 145.26 42.19 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.752 1.019 . . . . 2.28 113.752 167.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 124.5 15.51 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.715 2.006 . . . . 4.14 111.983 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 85.06 -13.58 53.67 Favored Glycine 0 N--CA 1.469 0.844 0 N-CA-C 115.645 1.018 . . . . 3.97 115.645 -173.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.578 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 12.8 m-20 -132.61 -155.94 0.72 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.134 0.967 . . . . 3.79 113.335 -147.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.578 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -101.12 -179.37 4.02 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.635 1.974 . . . . 4.33 112.738 -170.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.94 154.83 18.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.0 1.111 . . . . 3.33 114.0 170.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 65.2 mtm -142.11 131.18 23.22 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.523 1.529 . . . . 1.92 112.289 -176.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.26 120.13 24.99 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.455 0.702 . . . . 2.06 112.602 173.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 6.6 mp -115.58 151.43 34.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.187 1.795 . . . . 1.12 110.557 171.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 12.8 p -136.49 -179.58 5.77 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.707 1.603 . . . . 1.51 112.605 -164.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -44.97 137.86 3.93 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.408 1.083 . . . . 2.04 113.354 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.09 -8.28 71.25 Favored Glycine 0 CA--C 1.537 1.409 0 N-CA-C 116.098 1.199 . . . . 1.2 116.098 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.54 ' HB2' HD12 ' A' ' 584' ' ' ILE . 12.0 m -77.88 167.84 20.86 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.534 1.134 . . . . 1.05 111.867 173.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -147.42 162.46 38.98 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.387 0.884 . . . . 3.45 113.387 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.29 -179.35 7.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.829 1.652 . . . . 2.28 111.736 176.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 125.51 30.7 0.89 Allowed Glycine 0 N--CA 1.473 1.146 0 C-N-CA 124.991 1.281 . . . . 3.24 116.069 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 58.35 -153.62 0.38 Allowed 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 119.0 1.4 . . . . 7.21 112.142 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . 0.428 HG22 HG22 ' A' ' 614' ' ' THR . 2.3 mp -110.06 128.86 65.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.904 1.229 . . . . 5.54 110.996 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 5.7 t -150.89 -165.39 2.25 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.976 1.71 . . . . 5.18 110.775 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 64.8 mt 63.04 -70.63 0.06 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 128.883 2.873 . . . . 2.23 113.593 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.16 -1.52 36.54 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.358 1.463 . . . . 4.84 113.606 174.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . 0.428 HG22 HG22 ' A' ' 610' ' ' ILE . 5.8 t -157.38 175.06 14.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 126.936 2.095 . . . . 3.21 109.441 173.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.7 ptp85 -140.12 125.86 19.36 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.716 -0.615 . . . . 7.85 110.641 162.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -176.46 156.09 20.26 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.27 0.868 . . . . 2.46 115.27 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -70.43 154.7 41.61 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 127.038 2.135 . . . . 5.78 113.05 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -133.46 173.21 11.73 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.155 1.782 . . . . 7.27 112.463 168.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 10.2 p -99.66 121.74 41.66 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.823 0.849 . . . . 4.84 109.395 154.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.53 148.65 24.62 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.81 1.041 . . . . 2.21 113.81 -176.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 36.1 t -159.03 136.14 9.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.013 1.325 . . . . 2.78 111.652 172.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.2 p -152.63 140.96 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 121.355 -0.841 . . . . 1.13 112.633 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -121.73 152.98 38.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.302 1.441 . . . . 5.02 114.859 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -71.8 120.28 17.17 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.097 0.959 . . . . 0.97 110.476 172.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.31 -26.54 61.99 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.918 -0.489 . . . . 2.6 111.167 173.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -148.76 176.69 10.16 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.193 1.397 . . . . 0.95 110.098 -170.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -59.26 103.85 0.21 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.436 -1.32 . . . . 2.65 107.436 165.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -109.74 125.26 52.49 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.985 1.314 . . . . 2.23 108.955 -170.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.68 113.42 22.53 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 125.422 1.489 . . . . 4.1 108.008 165.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 20.2 mt -112.02 176.8 4.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.165 -1.379 . . . . 1.01 110.338 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -127.95 155.86 43.57 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.484 1.514 . . . . 7.07 109.576 168.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 8.7 p -133.12 136.37 45.78 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.497 1.295 . . . . 1.77 114.497 163.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.455 ' HG ' HD13 ' A' ' 560' ' ' LEU . 4.3 tt -128.88 127.02 40.99 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.45 1.9 . . . . 1.39 109.871 -174.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 36.5 p -95.26 140.47 30.11 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.855 1.057 . . . . 2.25 113.855 -175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.7 m -69.39 -18.34 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 O-C-N 120.534 -1.354 . . . . 2.09 112.504 173.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -58.4 -33.55 69.76 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.969 1.308 . . . . 2.97 111.909 171.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -90.62 -32.67 16.16 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.443 1.097 . . . . 2.26 112.523 170.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -54.24 -48.43 71.13 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.787 1.631 . . . . 2.67 112.61 174.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -70.15 -9.78 56.72 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.557 1.143 . . . . 2.38 113.279 177.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -93.53 -43.7 8.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 128.178 2.591 . . . . 5.14 112.724 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.86 -32.43 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 124.003 0.921 . . . . 1.32 111.755 173.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 4.0 mt -57.75 -24.48 57.25 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.118 1.155 . . . . 2.18 114.118 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.21 -31.84 65.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.422 1.089 . . . . 3.69 112.378 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -74.87 -23.51 58.42 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.715 1.206 . . . . 2.8 113.549 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -127.17 69.82 74.45 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.726 1.211 . . . . 2.37 112.902 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.75 -21.22 62.42 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.498 2.799 . . . . 1.32 115.175 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 42.7 ttp -63.92 -47.1 81.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.805 1.184 . . . . 1.52 111.191 168.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.46 -32.44 71.37 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.531 -0.73 . . . . 1.6 110.813 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -56.02 -52.41 64.32 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 118.286 -0.864 . . . . 4.08 111.444 174.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . 0.408 ' HA ' ' HG2' ' A' ' 653' ' ' GLU . 18.4 ptt-85 -60.44 -40.18 90.19 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 112.939 0.718 . . . . 5.7 112.939 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.08 -30.06 64.0 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.478 1.111 . . . . 1.82 113.846 178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -92.43 -40.12 11.05 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 115.068 1.507 . . . . 2.64 115.068 177.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 650' ' ' ARG . 6.6 pt-20 -60.49 -31.88 70.89 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.006 1.275 . . . . 4.57 112.253 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.6 t -80.02 -41.01 26.63 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.885 1.674 . . . . 3.4 111.991 -172.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.0 p -67.88 -41.24 84.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 121.307 -0.871 . . . . 3.07 110.5 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -63.32 -17.8 62.93 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.518 1.303 . . . . 3.57 114.518 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 15.9 tt -106.15 -17.02 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.956 1.303 . . . . 6.4 113.998 171.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -97.13 -31.44 12.47 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.294 -1.504 . . . . 5.6 113.758 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -70.88 6.0 1.73 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 127.498 2.319 . . . . 5.34 117.15 -171.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.84 7.67 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 128.944 2.898 . . . . 5.96 117.387 -161.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.03 20.75 18.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.96 2.504 . . . . 6.61 114.672 -177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -87.1 8.46 23.54 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.437 1.495 . . . . 13.72 114.311 174.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -41.66 131.13 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 127.928 2.491 . . . . 11.91 114.687 -175.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -85.47 21.91 12.24 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 126.695 2.093 . . . . 17.03 115.721 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -65.12 8.64 0.13 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 128.076 2.55 . . . . 17.69 117.056 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.11 82.2 0.7 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.645 1.978 . . . . 24.72 111.059 170.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -149.73 160.82 43.23 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.292 1.437 . . . . 24.53 113.221 175.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 50.7 m -70.98 -56.66 5.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.891 0.876 . . . . 28.74 110.409 162.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.78 155.66 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.147 0.979 . . . . 32.9 112.106 -170.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 28.9 mt -79.5 130.78 35.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 122.628 0.371 . . . . 30.37 111.101 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 61.0 tp -106.54 137.76 43.96 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.818 1.247 . . . . 33.96 112.233 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 130.729 3.611 . . . . 38.09 117.002 174.831 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 115.241 1.571 . . . . 7.16 115.241 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 19.1 t -64.14 -41.77 97.06 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.932 1.086 . . . . 3.55 113.932 -159.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -34.54 77.87 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.722 -1.236 . . . . 5.75 113.221 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -68.55 -17.43 64.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.272 1.429 . . . . 5.66 112.879 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 55.5 mt -85.07 -45.23 12.29 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.079 0.952 . . . . 2.87 110.832 173.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -39.39 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 121.642 -0.661 . . . . 1.33 111.197 173.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.05 0.41 2.61 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.644 1.578 . . . . 1.83 114.639 170.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 4.1 t -87.12 -17.12 33.54 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.54 0.736 . . . . 3.03 111.607 176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 73.0 mtp -75.11 143.5 77.39 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.104 0.962 . . . . 2.68 111.205 167.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.21 -30.15 31.5 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.374 2.716 . . . . 1.87 111.977 -176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.47 -25.16 59.29 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.465 1.506 . . . . 2.53 113.84 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -108.76 1.28 20.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.858 1.663 . . . . 2.93 113.745 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.49 -35.1 73.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.567 1.175 . . . . 2.04 112.694 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -123.53 0.35 8.79 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.973 2.509 . . . . 3.71 111.745 -166.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -56.55 154.76 8.19 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.715 2.006 . . . . 2.0 112.257 167.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -63.27 123.58 81.1 Favored Pre-proline 0 CA--C 1.55 0.977 0 O-C-N 121.772 -0.58 . . . . 2.7 109.955 170.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -64.54 -13.78 40.69 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.844 3.03 . . . . 2.43 113.973 -171.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -90.43 -41.22 11.58 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.867 1.267 . . . . 3.19 109.399 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -57.88 -46.72 84.46 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.971 1.308 . . . . 2.27 112.117 170.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 5.3 m -66.11 -30.86 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.698 -0.626 . . . . 2.35 112.574 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.8 m -74.74 -43.51 54.59 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.893 1.677 . . . . 1.6 112.509 176.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.83 -19.87 63.04 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.41 -0.807 . . . . 1.07 112.433 178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 18.2 ttm -71.95 -16.13 62.09 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.457 1.503 . . . . 1.05 114.421 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 19.8 mt -91.53 -11.36 37.6 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.228 1.411 . . . . 1.18 114.387 -171.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 75.2 p -59.02 -23.64 62.12 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.517 1.673 . . . . 1.89 115.517 -167.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.22 20.0 10.61 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 115.314 1.598 . . . . 2.48 115.314 175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.1 137.19 22.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.666 1.186 . . . . 2.74 112.98 -171.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.54 152.99 18.1 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.163 1.385 . . . . 1.9 112.759 -178.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -134.32 136.62 43.6 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.693 1.197 . . . . 2.77 111.799 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -139.43 151.38 46.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.027 1.731 . . . . 3.42 110.845 -173.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.28 148.06 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.681 1.192 . . . . 1.33 112.15 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -135.3 146.45 48.5 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.468 1.507 . . . . 2.16 109.997 168.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -95.03 161.53 27.96 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 123.984 0.914 . . . . 2.8 110.673 174.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -53.13 131.67 44.11 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 123.33 2.687 . . . . 0.98 113.836 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 106.14 -15.3 43.59 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 125.568 1.556 . . . . 1.02 114.24 171.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -82.97 130.09 35.1 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.714 1.257 . . . . 1.87 112.445 -167.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -65.15 108.8 1.97 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.357 0.598 . . . . 2.52 110.402 171.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 15.8 pt -74.74 -35.78 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.604 0.762 . . . . 1.4 112.993 -165.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 38.6 mt -122.36 143.27 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 125.166 1.387 . . . . 1.51 112.456 -164.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -137.87 141.2 40.72 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.402 2.281 . . . . 7.85 109.207 166.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -92.59 145.18 24.63 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.981 0.912 . . . . 4.98 111.897 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -166.37 6.16 0.06 OUTLIER Glycine 0 CA--C 1.537 1.447 0 CA-C-O 117.491 -1.727 . . . . 3.85 116.41 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.4 t -157.51 168.84 26.14 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.809 2.304 . . . . 3.07 114.529 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.8 mp -98.14 139.28 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.816 1.646 . . . . 2.02 109.662 176.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 73.14 55.6 6.19 Favored Glycine 0 N--CA 1.474 1.172 0 O-C-N 121.41 -0.806 . . . . 2.29 111.801 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -86.76 164.93 16.42 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 114.88 1.437 . . . . 5.9 114.88 -168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . 0.457 ' HE3' ' CZ ' ' A' ' 582' ' ' TYR . 0.0 OUTLIER -84.33 158.4 21.17 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.434 1.094 . . . . 3.81 111.122 171.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 10.7 tpt -90.01 148.07 23.29 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.422 1.089 . . . . 2.8 113.215 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . 0.457 ' CZ ' ' HE3' ' A' ' 580' ' ' LYS . 64.2 m-85 -122.76 138.59 54.58 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.444 1.098 . . . . 3.68 111.796 161.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.18 161.14 43.06 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.323 1.049 . . . . 3.19 112.079 177.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 605' ' ' SER . 14.0 mt -94.31 109.23 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 O-C-N 121.067 -1.021 . . . . 0.95 110.845 -159.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -47.6 17.77 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.964 0.802 . . . . 2.79 110.802 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -151.98 127.57 10.1 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.144 1.378 . . . . 2.9 110.398 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 136.59 -167.37 24.55 Favored Glycine 0 C--N 1.336 0.541 0 O-C-N 121.009 -1.057 . . . . 0.98 111.04 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.13 150.85 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 124.342 1.057 . . . . 1.1 109.165 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.42 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 27.4 m -128.39 152.87 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 125.705 1.602 . . . . 1.11 111.187 173.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.6 m -113.53 127.3 56.04 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 105.905 -1.887 . . . . 1.37 105.905 168.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 1.9 p -142.6 152.09 17.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 N-CA-C 106.771 -1.566 . . . . 3.13 106.771 -142.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 5.3 mp -122.24 130.27 53.02 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.398 -0.964 . . . . 3.67 108.398 158.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -82.53 131.55 35.21 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 119.913 -0.715 . . . . 3.04 110.118 166.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . 0.501 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 0.3 OUTLIER -57.04 -35.01 68.79 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 115.874 1.805 . . . . 4.72 115.874 -162.046 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -77.64 -14.11 82.77 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 124.409 1.004 . . . . 4.58 114.704 174.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 22.1 m-20 -137.49 -148.23 0.27 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.69 0.796 . . . . 4.25 111.259 -142.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.2 170.47 7.86 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.179 1.792 . . . . 3.59 115.445 -169.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -68.02 118.49 11.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.964 -1.471 . . . . 4.06 111.017 167.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 40.4 mtm -119.31 175.9 5.59 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 125.366 1.467 . . . . 2.43 112.622 175.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.03 156.83 17.18 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.563 1.145 . . . . 2.67 113.016 140.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.82 146.39 51.56 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 112.654 -2.066 . . . . 1.1 109.967 168.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 97.4 p -130.44 170.15 14.58 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.046 0.938 . . . . 1.59 113.491 -177.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.44 142.29 22.44 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.417 1.265 . . . . 2.33 114.417 -169.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.99 -2.67 87.31 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 123.796 0.712 . . . . 1.2 114.558 -166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 584' ' ' ILE . 69.6 m -82.5 167.42 18.41 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.664 1.186 . . . . 1.04 112.084 165.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 47.3 p90 -146.18 150.13 35.27 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.189 0.811 . . . . 3.69 113.189 -172.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.03 -179.1 3.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 116.138 1.903 . . . . 2.23 116.138 -170.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 85.03 1.16 88.85 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 117.967 1.947 . . . . 2.84 117.967 142.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . 0.549 ' HG3' ' H ' ' A' ' 610' ' ' ILE . 1.8 tp10 57.87 175.57 0.05 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.773 2.029 . . . . 7.11 115.002 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . 0.549 ' H ' ' HG3' ' A' ' 609' ' ' GLU . 4.5 mp -71.23 114.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.277 -1.515 . . . . 6.13 110.745 -173.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 35.0 t -121.42 -132.37 0.29 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 5.13 107.524 159.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 tm? 66.76 -58.21 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.164 2.586 . . . . 2.04 114.164 171.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.46 1.79 25.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.267 2.227 . . . . 4.02 113.923 174.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 8.8 t -135.44 141.51 45.42 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.021 1.729 . . . . 2.89 110.791 174.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -93.92 125.23 38.42 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.321 1.049 . . . . 6.68 111.379 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.48 163.95 18.67 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 125.577 1.561 . . . . 2.2 112.653 172.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 9.4 mmm180 -66.58 139.1 57.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.629 1.972 . . . . 4.41 110.377 167.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 74.9 mmt-85 -130.12 101.84 5.98 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.206 1.002 . . . . 6.19 111.474 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 86.0 m -93.98 137.05 33.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.328 1.051 . . . . 3.08 112.417 -171.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -158.67 153.25 24.46 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 126.75 2.02 . . . . 1.78 113.004 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 18.1 t -117.94 108.17 14.96 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 126.935 2.094 . . . . 2.47 112.654 -174.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.24 147.39 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 O-C-N 120.842 -1.161 . . . . 0.96 113.941 178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -131.07 160.03 35.84 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.409 1.484 . . . . 4.21 113.508 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -67.21 129.39 39.74 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.038 0.935 . . . . 0.99 111.09 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . 0.42 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 6.1 t70 -75.52 -35.06 60.81 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.688 0.756 . . . . 2.6 110.467 170.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 9.5 t -149.95 -175.82 5.19 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.074 1.75 . . . . 1.13 108.12 -164.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -56.48 102.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 120.861 -1.15 . . . . 2.56 108.714 160.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.4 p -104.28 124.34 48.98 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.203 1.001 . . . . 2.53 108.739 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 16.9 ttp-105 -106.58 115.7 30.66 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 124.035 1.874 . . . . 3.46 108.589 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 23.5 mt -114.3 156.19 24.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 112.944 -1.935 . . . . 0.92 108.694 -168.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . 0.251 8.2 p90 -124.15 150.29 45.3 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.133 0.573 . . . . 6.48 109.822 178.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 26.6 p -140.4 140.07 35.4 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.594 0.961 . . . . 1.81 113.594 -173.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.21 129.24 29.22 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.246 1.018 . . . . 1.35 111.3 -174.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 45.0 t -87.77 141.17 28.81 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.236 1.199 . . . . 2.05 114.236 -178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -23.9 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.733 0.813 . . . . 2.2 113.019 171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -65.33 -30.18 71.0 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.273 -1.517 . . . . 2.78 111.735 172.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -78.65 -34.51 46.33 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.502 -0.761 . . . . 2.16 111.54 170.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -54.04 -52.33 61.21 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.771 0.828 . . . . 4.17 111.5 171.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -70.01 -10.25 58.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.237 1.015 . . . . 1.89 113.6 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -87.81 -44.72 10.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.654 1.981 . . . . 5.23 112.169 174.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.18 -30.72 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 124.276 1.03 . . . . 0.94 112.412 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 649' ' ' ARG . 8.0 tt -48.34 -38.87 20.25 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.626 1.571 . . . . 4.32 112.325 170.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.99 -20.19 65.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.55 1.315 . . . . 2.98 114.55 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -74.57 -20.82 59.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.276 1.398 . . . . 3.13 112.902 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -127.98 77.28 76.77 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 126.037 1.735 . . . . 2.32 110.783 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.94 -20.45 44.71 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.296 2.664 . . . . 1.79 116.769 -175.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -77.35 -28.15 52.91 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 122.088 2.222 . . . . 1.62 111.248 171.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 24.2 mmt -79.52 -30.37 41.83 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.543 1.537 . . . . 2.55 111.5 174.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . 0.403 ' HA ' HD21 ' A' ' 642' ' ' LEU . 1.6 tmt_? -47.72 -52.42 18.53 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.749 1.22 . . . . 4.79 110.115 163.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 38.4 ttm-85 -64.94 -48.55 73.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.38 1.872 . . . . 7.0 112.575 174.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.02 -24.55 62.91 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.996 1.48 . . . . 1.91 114.996 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -91.81 -23.93 19.54 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 116.648 2.092 . . . . 2.28 116.648 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.05 -38.23 18.06 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.918 -1.114 . . . . 4.1 110.984 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.2 t -68.98 -8.08 41.41 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.952 2.101 . . . . 3.55 113.817 -177.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.37 -40.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 C-N-CA 127.454 2.302 . . . . 2.69 111.282 -178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -60.61 -28.99 68.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.474 0.71 . . . . 2.78 112.109 177.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.7 pp -65.77 -9.0 7.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 114.855 1.428 . . . . 4.83 114.855 174.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -139.79 -22.55 0.87 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.339 1.427 . . . . 4.73 114.521 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -75.71 -36.5 59.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.556 1.142 . . . . 6.76 112.259 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.55 -63.96 0.96 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.289 1.436 . . . . 5.28 110.44 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -129.03 131.6 47.39 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.821 2.048 . . . . 8.6 107.861 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -72.44 -41.88 65.66 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.465 0.913 . . . . 12.58 113.465 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 22.0 mm 66.21 -34.72 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 126.417 1.887 . . . . 11.91 115.059 -179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 99.8 69.26 0.89 Allowed Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.512 1.529 . . . . 15.67 113.88 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.82 174.78 11.85 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.677 1.591 . . . . 17.02 112.052 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -113.58 153.49 28.72 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 125.526 1.531 . . . . 22.24 112.224 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -137.72 179.28 6.51 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.724 1.609 . . . . 23.56 110.765 176.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 35.2 p -68.22 -78.76 0.06 Allowed 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.125 -0.984 . . . . 26.49 110.88 169.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 31.1 pt -143.22 152.25 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 126.776 2.03 . . . . 29.67 110.628 -176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -148.78 155.75 41.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.599 1.16 . . . . 26.85 112.321 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 38.7 tp -65.03 137.01 57.44 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.75 0.82 . . . . 29.58 111.759 178.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.258 1.552 0 C-N-CA 129.658 3.183 . . . . 33.61 115.147 -174.783 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 11.8 p30 . . . . . 0 CA--C 1.549 0.918 0 N-CA-C 110.918 -0.03 . . . . 8.61 110.918 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 62.9 m 50.41 -135.29 1.39 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.98 1.312 . . . . 6.81 111.871 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 ptp85 -63.05 -28.57 70.18 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.028 1.285 . . . . 4.53 114.382 -172.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -57.38 -24.31 54.57 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 114.758 1.392 . . . . 6.7 114.758 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 74.9 mt -65.76 -40.77 92.37 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.646 1.178 . . . . 2.56 112.219 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -90.5 -40.84 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.355 1.062 . . . . 1.76 111.046 172.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.18 -2.53 19.09 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 115.453 1.649 . . . . 2.57 115.453 -169.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 96.5 p -73.55 -26.79 61.01 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.086 0.857 . . . . 4.25 111.599 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.92 156.03 88.46 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 126.141 1.776 . . . . 3.42 114.267 -174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -67.22 -21.57 47.96 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 123.953 3.102 . . . . 4.06 112.467 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 9.2 mt -61.25 -18.47 58.57 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.261 1.024 . . . . 3.12 112.697 171.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -121.08 17.19 11.65 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.818 1.647 . . . . 2.89 112.681 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -46.58 -38.33 9.37 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.964 1.306 . . . . 4.31 112.948 170.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.29 1.22 12.41 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.766 1.627 . . . . 5.32 113.397 -172.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.85 141.62 57.85 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.578 0.955 . . . . 2.41 113.578 -173.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.86 138.12 82.58 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 124.259 1.024 . . . . 2.17 109.724 166.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 553' ' ' VAL . 68.5 Cg_endo -65.27 -22.0 61.09 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.671 2.248 . . . . 1.13 113.495 -178.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -77.21 -41.86 39.68 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.906 -1.121 . . . . 1.79 111.087 175.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -56.81 -54.38 46.98 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.358 1.463 . . . . 2.64 111.193 174.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 550' ' ' PRO . 3.3 p -66.53 -28.54 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.452 0.701 . . . . 2.35 112.166 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 93.2 m -81.79 -35.79 29.16 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.376 1.47 . . . . 1.5 112.778 177.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.79 -27.05 66.41 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.255 -0.903 . . . . 1.71 110.853 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 27.4 ttm -62.12 -28.27 69.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.679 1.191 . . . . 1.21 112.385 175.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 17.8 mt -78.54 -15.46 58.55 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.272 1.429 . . . . 1.82 112.758 -175.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 40.1 p -56.81 -40.18 75.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.355 1.062 . . . . 2.38 113.028 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -97.69 -0.05 46.2 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.397 1.479 . . . . 2.65 114.303 -174.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 3.1 mt -52.32 123.95 12.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.632 0.773 . . . . 3.16 111.787 -162.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.02 148.37 23.56 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.434 1.094 . . . . 1.88 110.913 -172.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.37 148.93 45.06 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 114.161 1.171 . . . . 2.71 114.161 -173.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -136.8 147.93 46.9 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.801 2.041 . . . . 3.48 110.391 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 17.5 t -115.49 141.64 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.071 0.948 . . . . 1.34 110.46 178.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -122.85 139.27 54.2 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.329 1.051 . . . . 2.4 110.774 173.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -98.82 164.51 16.76 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.193 1.397 . . . . 2.2 111.642 -171.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -55.84 124.07 15.36 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.435 2.09 . . . . 2.09 113.306 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.0 -6.63 82.64 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.47 1.509 . . . . 1.61 113.553 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -87.11 135.11 33.41 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.252 1.526 . . . . 2.78 111.929 -173.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -63.84 129.42 40.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.986 0.915 . . . . 3.28 110.908 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 pp -97.03 -16.98 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 N-CA-C 114.425 1.268 . . . . 1.26 114.425 -168.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . 0.442 HG12 HG13 ' A' ' 622' ' ' VAL . 14.3 mm -95.3 150.95 3.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 123.608 0.763 . . . . 2.69 110.412 -164.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -135.92 162.62 32.33 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.609 1.564 . . . . 11.97 111.259 178.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -39.8 134.04 1.47 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.118 1.767 . . . . 6.68 114.527 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -122.13 41.55 1.82 Allowed Glycine 0 C--N 1.339 0.725 0 C-N-CA 125.266 1.412 . . . . 6.18 111.024 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.6 t -65.49 162.95 16.9 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.711 0.767 . . . . 4.32 110.027 166.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.69 121.52 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.271 -0.64 . . . . 4.09 109.271 -167.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 95.36 -1.1 64.12 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.046 -1.419 . . . . 2.37 114.165 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 44.8 mttp -73.74 145.82 44.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.259 1.529 . . . . 6.34 111.732 166.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 31.0 pttt -85.62 -176.23 5.97 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.032 1.493 . . . . 3.32 115.032 -157.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -102.22 145.09 29.91 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.811 1.644 . . . . 1.89 112.226 -170.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.23 152.21 50.72 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.445 1.498 . . . . 4.25 111.738 -177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.1 168.3 26.94 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.725 1.21 . . . . 2.58 112.002 179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 40.5 mt -102.16 107.76 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.436 1.094 . . . . 1.22 110.919 -165.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -75.63 -50.79 14.43 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.206 0.912 . . . . 3.22 112.363 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -156.63 122.8 4.95 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.186 0.995 . . . . 3.74 113.343 170.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 154.55 -154.31 25.42 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 124.719 1.152 . . . . 1.59 111.513 166.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 59.1 t -140.06 144.04 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.195 1.398 . . . . 1.88 109.722 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.2 m -126.71 153.03 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.534 1.134 . . . . 1.85 111.516 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 46.5 m -117.16 125.25 50.91 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.515 1.926 . . . . 2.39 108.247 176.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.23 148.28 17.87 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.277 -0.874 . . . . 3.54 109.126 -140.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.17 129.11 53.97 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.594 -1.261 . . . . 2.34 107.594 161.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.33 140.6 29.55 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 113.099 0.777 . . . . 2.87 113.099 169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.27 138.63 56.2 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.327 0.651 . . . . 4.62 111.088 175.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 80.63 -19.09 7.62 Favored Glycine 0 N--CA 1.472 1.095 0 N-CA-C 115.521 0.968 . . . . 3.85 115.521 -168.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -133.82 -158.35 0.88 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 117.602 0.701 . . . . 3.8 112.23 -152.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.01 172.44 6.79 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.675 1.361 . . . . 4.02 114.675 -163.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.15 128.23 35.25 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.309 -0.859 . . . . 3.97 111.366 166.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 30.0 mtm -131.45 177.41 7.51 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 127.298 2.239 . . . . 2.79 112.028 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -105.01 158.37 16.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.758 1.623 . . . . 2.48 112.992 142.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.83 149.97 50.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.68 1.992 . . . . 1.85 110.312 168.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 84.3 p -120.47 176.66 5.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.897 1.279 . . . . 1.72 113.682 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . 0.25 2.7 p30 -69.99 153.99 42.51 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.393 -1.442 . . . . 3.46 114.645 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.47 1.94 89.12 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 124.185 0.897 . . . . 1.36 114.992 -166.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 72.9 m -100.0 162.27 13.09 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.483 1.513 . . . . 1.18 112.682 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -112.97 148.63 34.65 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.208 1.803 . . . . 5.48 112.14 -172.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -111.14 159.96 17.36 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 115.005 1.483 . . . . 2.9 115.005 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 79.28 -136.99 18.45 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 115.349 -0.842 . . . . 4.32 112.521 170.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -142.23 10.01 1.89 Allowed 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 125.195 1.398 . . . . 6.19 113.49 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 43.3 mt 64.27 140.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 127.062 2.145 . . . . 6.73 114.182 -172.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 59.7 m -130.22 133.06 46.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.617 -1.253 . . . . 5.44 107.617 147.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.446 HD22 ' HB ' ' A' ' 635' ' ' VAL . 2.8 tm? -158.18 -62.42 0.08 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.181 0.992 . . . . 2.59 109.031 174.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -117.83 -14.23 10.1 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.893 0.877 . . . . 3.46 113.14 153.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.68 166.38 21.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.403 1.081 . . . . 3.96 112.254 166.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -157.59 147.34 20.29 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.612 1.338 . . . . 6.89 114.612 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 164.64 157.52 9.64 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 124.75 1.167 . . . . 3.88 114.583 165.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 27.0 mmt180 -57.39 123.55 15.82 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 126.384 1.873 . . . . 3.67 112.311 172.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 38.1 mtm-85 -102.33 146.42 28.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.369 1.068 . . . . 9.46 113.843 177.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 47.5 p -132.34 132.45 42.94 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.699 1.199 . . . . 3.55 110.333 167.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.56 109.36 2.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.047 0.939 . . . . 2.24 112.059 -178.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.5 t -92.32 96.22 10.15 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.317 1.447 . . . . 3.67 110.216 176.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . 0.442 HG13 HG12 ' A' ' 572' ' ' ILE . 1.7 p -152.65 139.47 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 O-C-N 120.847 -1.158 . . . . 1.96 113.616 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -129.86 161.74 30.11 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.66 1.984 . . . . 4.47 112.168 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -76.46 144.26 39.99 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 120.861 -1.15 . . . . 1.62 112.281 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.88 -25.68 56.36 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 122.628 1.204 . . . . 3.62 111.705 169.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.8 t -160.73 178.63 9.26 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.279 2.632 . . . . 2.0 108.666 -154.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.9 125.11 24.88 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.738 -1.226 . . . . 2.49 109.757 164.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 8.9 t -134.53 122.04 21.84 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.907 1.283 . . . . 1.97 111.142 -173.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -81.58 114.39 20.25 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.53 1.532 . . . . 4.24 108.991 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.0 mt -103.44 158.97 15.98 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.782 1.233 . . . . 1.21 110.232 170.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -135.62 158.17 45.05 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 123.782 0.833 . . . . 6.67 110.288 175.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 91.9 p -143.94 156.19 44.34 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.873 1.434 . . . . 1.71 114.873 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.7 tt -130.44 121.26 25.54 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.946 1.298 . . . . 1.93 111.029 -173.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 57.7 p -83.76 129.51 34.94 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 114.02 1.119 . . . . 2.45 114.02 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.446 ' HB ' HD22 ' A' ' 612' ' ' LEU . 0.2 OUTLIER -66.48 -27.87 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 O-C-N 121.0 -1.062 . . . . 2.57 111.581 171.498 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -58.93 -31.66 68.87 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.829 -0.544 . . . . 3.08 111.82 174.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -86.07 -35.97 19.95 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.787 0.835 . . . . 4.37 112.375 172.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.436 ' CG ' HD21 ' A' ' 612' ' ' LEU . 16.0 t80 -48.8 -43.49 38.23 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.593 1.088 . . . . 3.16 111.668 170.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -65.93 -22.26 66.48 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.417 1.487 . . . . 2.97 114.242 175.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -83.52 -49.58 9.11 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.705 1.602 . . . . 3.42 112.706 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 1.6 p -70.35 -24.21 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 121.216 -0.928 . . . . 1.56 112.145 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.8 -25.74 42.87 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.384 1.624 . . . . 2.57 115.384 167.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.34 -31.37 65.66 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.747 1.158 . . . . 4.8 113.289 179.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -81.09 -17.76 48.91 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.096 1.759 . . . . 3.1 113.674 -173.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -132.69 69.43 79.48 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.324 1.85 . . . . 2.54 112.367 -169.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -54.41 -28.44 53.92 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.518 2.812 . . . . 1.77 114.778 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -47.62 -47.9 28.74 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.002 1.274 . . . . 1.8 111.653 169.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 7.0 tpt -81.22 -26.47 35.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.585 -0.734 . . . . 2.8 110.64 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 2.2 tmt_? -63.15 -50.51 70.14 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 118.527 -0.749 . . . . 4.62 110.789 170.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 24.4 ptt-85 -65.77 -34.69 78.76 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 113.904 1.076 . . . . 6.99 113.904 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.61 -26.62 63.87 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.718 1.207 . . . . 2.82 114.081 173.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 41.9 m-85 -91.96 -29.1 16.82 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.877 0.871 . . . . 3.25 113.343 170.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -60.27 -34.69 74.09 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.322 -1.486 . . . . 3.96 112.549 172.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 12.1 t -71.66 -30.73 66.05 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.641 0.776 . . . . 4.28 112.681 -173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 6.3 p -86.37 -36.1 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.582 1.553 . . . . 4.79 111.881 174.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -58.77 -31.3 68.24 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.101 0.778 . . . . 5.29 113.101 178.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 19.1 tt -77.91 -45.26 27.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 118.728 0.694 . . . . 7.39 112.439 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -74.9 -33.75 62.08 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.927 1.455 . . . . 6.72 114.927 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -74.06 -13.81 60.9 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.031 1.332 . . . . 7.43 113.574 -178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -97.51 -24.79 15.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.379 1.871 . . . . 8.73 112.086 161.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 1.6 t0 59.27 173.51 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.96 2.904 . . . . 12.14 113.88 -171.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -68.06 -46.79 70.12 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 120.676 -1.265 . . . . 19.46 112.408 -171.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 18.8 mm 60.58 -34.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 C-N-CA 128.208 2.603 . . . . 17.69 115.635 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 80.8 18.12 71.06 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.733 1.159 . . . . 22.31 112.788 -158.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 145.41 47.62 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.969 1.384 . . . . 22.52 112.42 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.95 121.94 15.31 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.671 0.788 . . . . 31.11 110.265 178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -74.87 137.58 41.88 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.21 1.004 . . . . 28.21 110.996 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 60.8 m -67.05 -60.88 2.25 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.081 0.952 . . . . 30.82 112.967 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 42.6 pt -130.62 155.01 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.45 0.7 . . . . 32.58 112.132 -167.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.17 171.66 7.31 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.833 1.253 . . . . 35.08 112.639 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 65.4 tp -134.4 134.61 41.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.495 1.518 . . . . 36.74 110.526 167.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 . . . . . 0 C--O 1.252 1.218 0 C-N-CA 129.102 2.961 . . . . 42.75 114.811 159.035 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 48.7 t30 . . . . . 0 CA--C 1.543 0.704 0 CA-C-O 121.811 0.815 . . . . 7.42 111.698 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.2 p -86.46 -26.56 24.59 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.408 1.083 . . . . 4.0 112.864 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -61.34 -26.94 68.15 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.22 1.408 . . . . 5.91 114.528 -178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -25.85 63.42 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.813 0.845 . . . . 4.86 113.19 172.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.76 -44.71 10.93 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.475 1.11 . . . . 3.03 111.445 -170.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.84 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 O-C-N 121.218 -0.926 . . . . 1.15 110.46 171.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -69.31 -7.42 36.99 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.313 1.445 . . . . 1.62 114.702 174.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.4 m -91.92 -3.62 55.72 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.92 -1.112 . . . . 2.65 112.731 -177.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 71.2 mtp -77.42 146.82 74.57 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 125.199 1.399 . . . . 2.69 111.935 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.38 -24.74 22.38 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.491 2.794 . . . . 1.67 112.581 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.25 -20.85 64.83 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.061 0.944 . . . . 3.22 112.238 172.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -105.85 0.47 26.0 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.549 1.94 . . . . 2.34 113.66 -170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -52.03 -47.49 64.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.478 1.511 . . . . 1.95 112.405 -173.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -107.0 13.04 28.0 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.293 2.637 . . . . 3.4 111.47 -172.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -60.97 151.37 30.66 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.582 1.327 . . . . 1.22 114.582 -172.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -59.26 122.67 65.36 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 109.206 -0.664 . . . . 2.41 109.206 163.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -66.88 -10.75 29.5 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.136 2.558 . . . . 1.29 113.914 -171.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -92.81 -37.93 12.04 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.942 1.697 . . . . 2.33 110.783 177.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -56.1 -49.74 73.01 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.209 1.004 . . . . 2.3 111.02 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -62.85 -34.57 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 121.285 0.564 . . . . 1.52 111.712 -178.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 92.7 m -81.35 -39.97 24.26 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 126.128 1.771 . . . . 1.18 112.909 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.97 -23.41 65.04 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.34 -0.85 . . . . 0.94 111.307 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 33.9 ttm -67.94 -20.76 65.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.555 1.542 . . . . 1.0 113.525 176.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.55 -27.76 37.47 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.619 1.168 . . . . 1.36 112.491 -176.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 41.2 p -52.08 -30.15 24.68 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.431 1.892 . . . . 2.08 115.627 -168.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.95 21.72 8.15 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.467 1.907 . . . . 4.53 115.64 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 5.0 mt -64.16 161.35 16.5 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.91 0.884 . . . . 2.59 112.095 -178.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -122.97 153.3 39.93 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.089 1.355 . . . . 2.3 112.096 171.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.56 151.72 32.94 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.674 1.19 . . . . 2.29 112.31 173.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -151.94 156.97 41.13 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.583 1.153 . . . . 2.81 112.015 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.49 HG11 ' CE1' ' A' ' 627' ' ' TYR . 2.4 t -129.88 145.42 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 O-C-N 120.671 -1.268 . . . . 1.34 111.875 177.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -113.07 137.53 51.29 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.532 1.133 . . . . 2.12 109.88 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -86.07 163.88 41.17 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.617 1.167 . . . . 3.24 110.733 -175.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.84 135.62 68.18 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.503 2.135 . . . . 1.03 113.868 -173.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 90.3 -4.2 82.53 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 125.835 1.683 . . . . 1.12 113.536 172.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -91.22 132.59 36.01 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.593 1.157 . . . . 2.14 113.256 -163.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -72.5 111.46 7.7 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.281 1.032 . . . . 2.85 110.932 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.32 -24.6 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 N-CA-C 114.382 1.253 . . . . 1.34 114.382 -168.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 30.1 mm -97.41 141.54 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 125.287 1.435 . . . . 2.67 110.865 -167.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.23 114.02 6.46 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.256 0.836 . . . . 7.77 113.256 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.42 148.31 41.26 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.007 -1.058 . . . . 6.28 110.766 172.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 179.99 -25.73 0.05 OUTLIER Glycine 0 N--CA 1.469 0.883 0 N-CA-C 115.002 0.761 . . . . 3.71 115.002 171.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 15.1 t -157.1 164.16 38.18 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.837 1.319 . . . . 2.59 111.169 -174.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 5.3 mp -93.87 140.01 17.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 125.663 1.585 . . . . 2.6 109.501 168.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 90.01 35.94 7.42 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 123.763 0.697 . . . . 1.71 111.952 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -70.94 162.45 29.32 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.203 2.201 . . . . 4.23 112.422 -174.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -82.91 133.68 35.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.04 -1.038 . . . . 5.34 109.554 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 27.5 ttt -89.28 148.4 23.59 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.893 0.877 . . . . 2.17 112.921 -163.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -124.21 138.85 54.36 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.951 1.3 . . . . 4.28 111.095 174.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . 0.251 0.0 OUTLIER -142.37 159.45 42.21 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.111 -0.993 . . . . 2.7 111.484 168.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.582 HD12 ' HB2' ' A' ' 605' ' ' SER . 21.0 mt -93.87 107.63 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 122.935 0.494 . . . . 1.0 110.673 -162.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -54.81 6.21 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 118.744 -0.646 . . . . 3.78 112.104 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.95 119.25 4.71 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.228 1.411 . . . . 4.71 111.822 176.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.05 -170.2 28.7 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.071 1.319 . . . . 1.0 110.943 176.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.2 141.95 40.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 124.175 0.99 . . . . 0.87 109.621 -174.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.1 m -119.57 148.83 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.642 1.577 . . . . 0.78 109.485 171.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 69.0 m -116.53 127.41 54.5 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 122.858 1.313 . . . . 1.37 107.657 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -145.21 150.71 15.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.172 -1.377 . . . . 2.82 108.283 -136.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -119.27 132.75 55.95 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.746 -1.205 . . . . 2.37 107.746 158.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.3 p -93.31 134.95 35.0 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 120.047 1.294 . . . . 2.94 111.126 160.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.41 -20.09 57.46 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 116.016 1.858 . . . . 4.37 116.016 -159.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -74.07 -20.03 79.73 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-N 118.958 0.799 . . . . 5.12 113.968 162.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.557 ' HA ' ' HE2' ' A' ' 597' ' ' LYS . 52.7 m-20 -136.24 -146.31 0.23 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.048 0.939 . . . . 4.92 111.049 -143.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.557 ' HE2' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -104.52 173.49 6.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 115.081 1.511 . . . . 4.38 115.081 -168.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -64.79 139.84 58.8 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 114.832 -1.077 . . . . 4.15 111.067 158.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 27.6 mtm -139.26 177.36 7.97 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.86 1.264 . . . . 2.17 111.028 171.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -98.89 157.62 16.19 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.038 0.935 . . . . 2.48 111.584 134.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.16 148.93 49.31 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 126.347 1.859 . . . . 0.96 109.897 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.7 t -140.58 -176.69 4.73 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 124.124 0.97 . . . . 2.46 110.827 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -43.12 148.74 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.827 2.051 . . . . 3.6 115.336 -170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 83.42 -9.28 61.97 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 115.314 0.886 . . . . 1.98 115.314 -175.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.582 ' HB2' HD12 ' A' ' 584' ' ' ILE . 28.4 m -83.16 158.74 22.24 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.82 1.648 . . . . 1.64 111.738 171.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -149.34 145.34 26.96 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.607 1.336 . . . . 3.93 114.607 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -153.48 176.05 12.47 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 115.232 1.567 . . . . 2.52 115.232 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 172.12 -124.48 1.09 Allowed Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.789 1.661 . . . . 4.34 110.247 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.42 -20.56 16.4 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 118.37 1.085 . . . . 9.19 111.973 148.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp 57.57 99.2 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 128.613 2.765 . . . . 5.72 111.011 -153.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 15.7 t -110.94 -88.76 0.51 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.598 1.559 . . . . 6.33 109.028 156.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.591 HD23 ' HB ' ' A' ' 635' ' ' VAL 0.252 11.2 mt 56.86 -59.48 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 128.451 2.7 . . . . 3.24 114.224 -164.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 3.1 mp -128.83 -22.86 3.18 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.861 2.064 . . . . 4.98 111.877 172.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.81 172.48 13.29 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.981 1.313 . . . . 2.68 113.49 -173.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -125.31 157.11 37.51 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.15 1.38 . . . . 6.0 114.609 -172.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 89.78 145.52 12.88 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 125.936 1.731 . . . . 2.24 114.087 -172.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -100.56 143.66 30.46 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.668 1.587 . . . . 3.53 111.627 177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -133.03 157.9 44.07 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.988 1.715 . . . . 5.44 113.704 -165.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 14.6 p -112.5 165.64 12.04 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.016 2.526 . . . . 3.38 112.182 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -155.74 137.47 14.29 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.458 1.503 . . . . 2.0 109.615 156.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.9 m -88.25 96.83 10.71 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.05 -1.031 . . . . 2.34 110.131 175.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.7 p -151.44 143.95 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.333 -0.854 . . . . 1.38 112.251 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.1 ptm180 -129.42 157.82 40.9 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.98 1.712 . . . . 3.75 111.775 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -69.15 130.23 42.09 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.817 -0.552 . . . . 0.82 110.043 171.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -73.8 -24.51 59.83 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.145 -0.972 . . . . 2.23 111.525 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.1 t -160.43 177.98 10.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 129.47 3.108 . . . . 0.86 108.405 -159.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.49 ' CE1' HG11 ' A' ' 564' ' ' VAL . 43.4 t80 -73.67 98.26 2.84 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.473 -1.392 . . . . 3.23 108.939 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 12.0 t -106.69 121.54 44.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 125.094 1.358 . . . . 2.54 111.536 -165.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 58.7 ttp85 -92.01 118.99 31.31 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.836 1.254 . . . . 5.62 111.176 -176.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 21.4 mt -117.08 165.61 13.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.983 1.713 . . . . 0.94 109.948 -174.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -99.64 170.45 8.57 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.858 0.863 . . . . 7.57 110.655 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 65.0 m -142.5 127.99 19.0 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.925 -1.109 . . . . 2.07 112.003 164.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.3 tt -137.36 134.88 36.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.666 1.586 . . . . 1.66 110.021 -176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 52.1 p -83.71 137.35 33.8 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.489 0.662 . . . . 2.43 112.244 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.591 ' HB ' HD23 ' A' ' 612' ' ' LEU . 1.5 m -63.48 -23.57 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 120.774 -1.204 . . . . 2.41 111.607 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -64.63 -35.6 81.53 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.265 1.026 . . . . 2.87 112.944 173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 23.2 m120 -82.65 -33.14 27.88 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 118.086 -0.959 . . . . 2.37 112.136 171.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.414 ' CD1' HD22 ' A' ' 612' ' ' LEU . 42.4 t80 -57.95 -54.66 44.45 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.562 1.528 . . . . 2.28 111.603 172.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -67.44 -23.81 65.56 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.577 -0.702 . . . . 1.79 112.174 -177.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -76.75 -28.88 55.91 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.989 2.515 . . . . 4.04 113.68 175.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 14.6 p -87.81 -34.73 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 112.901 0.704 . . . . 1.07 112.901 170.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.55 -42.3 87.58 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.601 1.16 . . . . 2.09 112.241 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -8.69 46.0 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.578 1.696 . . . . 3.8 115.578 178.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.4 -17.44 56.42 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.683 1.129 . . . . 2.35 112.98 172.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -129.12 77.27 78.04 Favored Pre-proline 0 CA--C 1.54 0.567 0 C-N-CA 126.532 1.933 . . . . 2.11 110.266 -169.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -53.87 -23.03 25.84 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.749 2.966 . . . . 2.09 116.724 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 36.2 ttp -62.32 -38.09 88.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.437 1.471 . . . . 2.55 112.333 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 87.3 mmm -80.2 -28.14 38.71 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.13 -0.981 . . . . 2.29 111.557 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.03 -46.02 85.99 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.906 0.882 . . . . 6.05 111.332 172.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -28.23 65.72 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.069 1.507 . . . . 7.14 115.069 177.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -60.11 -25.5 65.5 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.67 1.188 . . . . 2.16 113.442 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -93.05 -19.48 21.51 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.183 1.179 . . . . 2.61 114.183 170.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.79 -34.32 71.65 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.083 1.311 . . . . 3.79 112.384 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.8 t -73.94 -24.04 59.59 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.25 1.42 . . . . 3.48 113.269 -174.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.7 p -86.19 -41.68 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 126.016 1.726 . . . . 3.4 111.176 171.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -50.28 -39.16 44.48 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.886 1.274 . . . . 3.16 113.999 -175.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 9.4 tp -76.06 -15.5 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.682 1.593 . . . . 4.64 114.842 -175.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -105.3 -31.33 9.13 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.737 -1.227 . . . . 5.34 111.77 167.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -57.85 -39.73 78.43 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.43 1.892 . . . . 8.77 113.04 177.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -64.66 -15.0 60.62 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.786 1.773 . . . . 6.68 115.786 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -70.66 148.14 48.38 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.188 0.904 . . . . 7.82 113.416 -171.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -95.12 -5.26 44.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.272 2.229 . . . . 14.3 117.015 -164.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.304 0.4 OUTLIER 21.46 -125.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 130.591 3.556 . . . . 12.26 114.672 -169.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -87.38 13.86 59.16 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 124.555 1.074 . . . . 16.64 114.958 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -122.91 -48.21 2.02 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.107 1.151 . . . . 17.8 114.107 -155.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -124.22 -175.41 3.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.84 1.656 . . . . 22.18 111.275 -172.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -108.87 165.76 11.33 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.597 1.159 . . . . 22.64 110.456 173.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.5 m -71.86 -177.98 2.16 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.395 1.078 . . . . 22.26 113.647 -172.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 28.4 pt -61.59 165.79 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 125.568 1.547 . . . . 24.73 113.959 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.91 134.71 48.71 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.062 0.945 . . . . 26.48 110.804 170.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.38 159.3 23.68 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.13 1.372 . . . . 29.29 113.863 -171.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 72.0 t60 . . . . . 0 C--O 1.257 1.493 0 C-N-CA 128.144 2.578 . . . . 34.91 115.096 -162.166 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 8.7 p30 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 114.372 1.249 . . . . 5.63 114.372 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 98.8 m 60.44 -17.05 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 118.991 2.96 . . . . 3.6 118.991 168.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -46.84 -50.81 17.91 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 120.557 1.526 . . . . 4.32 112.822 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -29.25 69.33 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.617 0.969 . . . . 4.01 113.617 -176.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 27.0 mt -85.21 -47.81 9.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.762 1.225 . . . . 2.54 111.918 -177.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -38.57 81.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.249 0.477 . . . . 1.03 110.305 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.26 -13.04 62.0 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.939 1.459 . . . . 1.4 114.939 173.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 7.9 t -83.63 -29.14 27.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.489 1.116 . . . . 2.57 111.713 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.41 133.15 93.02 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 127.229 2.212 . . . . 2.38 110.743 174.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -61.73 -25.41 78.74 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.331 2.687 . . . . 1.75 115.076 -168.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.3 tt -64.0 -23.17 67.23 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.706 1.602 . . . . 2.75 112.689 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -110.86 8.03 22.09 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.36 1.864 . . . . 2.09 113.136 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -56.23 -33.04 65.01 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.435 1.494 . . . . 1.76 113.442 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -118.33 12.36 13.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 128.159 2.584 . . . . 2.88 110.665 -170.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -66.85 154.46 40.86 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.731 1.011 . . . . 1.23 113.731 -178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -72.59 126.08 90.97 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 109.421 -0.585 . . . . 2.58 109.421 163.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -62.34 -17.42 57.31 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.34 2.693 . . . . 1.43 113.688 -172.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -88.7 -34.56 17.15 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.069 -1.019 . . . . 2.43 110.719 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -61.33 -48.15 82.64 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 125.22 1.408 . . . . 2.3 110.571 168.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 3.1 m -65.13 -33.25 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 112.38 0.511 . . . . 1.57 112.38 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 96.5 m -78.72 -45.84 20.32 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.764 1.626 . . . . 1.09 112.478 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -62.79 -17.95 61.96 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.462 -0.773 . . . . 1.07 112.735 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 21.5 ttm -73.41 -24.0 60.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.326 1.45 . . . . 0.96 114.003 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.8 mt -82.99 -8.12 59.6 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.395 1.078 . . . . 0.95 113.617 -169.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 2.8 t -50.93 -23.17 2.66 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 128.209 2.603 . . . . 2.55 115.47 -176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -119.25 5.67 11.22 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.911 1.684 . . . . 2.87 115.22 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.463 ' HA ' HD12 ' A' ' 560' ' ' LEU . 13.4 tp -67.54 145.21 55.14 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 113.74 1.015 . . . . 2.04 113.74 -151.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.82 145.78 47.23 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.919 1.288 . . . . 2.28 113.919 -160.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.98 148.63 49.22 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.502 1.297 . . . . 2.63 114.502 -170.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -143.75 157.71 44.19 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.231 1.012 . . . . 3.62 112.63 178.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 16.7 t -125.52 146.5 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 O-C-N 120.758 -1.214 . . . . 0.9 112.111 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.422 ' CG ' HG22 ' A' ' 571' ' ' ILE . 71.3 m-85 -123.71 146.25 48.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.448 1.099 . . . . 2.09 111.583 165.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -109.68 164.88 13.75 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 126.562 1.945 . . . . 3.1 110.448 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -60.14 134.92 58.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.622 2.215 . . . . 1.61 115.311 -158.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.55 -14.68 61.83 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 127.071 2.272 . . . . 1.42 113.053 175.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -84.59 122.55 29.2 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.328 1.064 . . . . 2.01 112.544 -165.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -64.49 121.73 15.09 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.4 1.08 . . . . 2.97 111.139 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.422 HG22 ' CG ' ' A' ' 565' ' ' PHE . 2.2 pp -85.88 -16.92 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 114.658 1.355 . . . . 1.64 114.658 -169.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 11.3 mt -128.42 135.82 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 C-N-CA 127.181 2.193 . . . . 1.95 112.678 -171.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -168.45 117.35 0.72 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.497 1.919 . . . . 8.83 109.409 160.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 575' ' ' GLY . 1.8 tt0 -93.44 172.05 8.52 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.54 1.536 . . . . 5.68 111.756 172.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' A' ' 574' ' ' GLU . . . -171.67 -6.88 0.03 OUTLIER Glycine 0 CA--C 1.536 1.346 0 O-C-N 120.86 -1.15 . . . . 3.88 114.894 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 8.8 t -159.49 154.88 25.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.372 1.869 . . . . 3.08 108.603 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -75.22 144.23 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 124.145 0.978 . . . . 2.16 109.944 -170.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 110.18 16.79 10.06 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.396 0.998 . . . . 1.62 114.924 171.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -72.43 159.04 34.63 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.894 1.347 . . . . 4.42 112.007 -179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -84.01 174.1 10.59 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.532 1.533 . . . . 4.28 111.569 -168.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -92.0 146.02 24.07 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.153 0.581 . . . . 2.18 111.47 171.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -135.72 147.07 48.32 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.633 1.173 . . . . 2.65 112.769 -178.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -148.83 157.57 43.53 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.456 1.28 . . . . 2.84 114.456 177.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 605' ' ' SER . 10.8 mt -91.68 117.87 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.49 0.716 . . . . 0.71 110.92 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -88.15 -57.35 2.96 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.041 -0.412 . . . . 3.03 110.501 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -143.59 120.84 11.54 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.115 0.966 . . . . 2.81 112.652 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 151.7 -151.77 23.64 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.781 1.181 . . . . 1.11 111.326 165.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 58.3 t -143.21 147.95 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 125.623 1.569 . . . . 1.04 110.012 177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.7 147.58 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 125.099 1.359 . . . . 0.92 111.374 170.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.8 m -108.9 131.05 55.4 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 105.965 -1.865 . . . . 1.41 105.965 169.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.4 p -144.8 147.85 18.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.24 -1.345 . . . . 3.13 107.683 -142.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -119.31 127.8 53.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.776 -1.194 . . . . 1.93 107.776 164.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 2.8 p -83.63 134.93 34.77 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.857 0.837 . . . . 2.66 110.92 161.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.92 132.79 42.83 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.362 -0.836 . . . . 4.57 110.567 -173.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.17 -14.46 53.72 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 115.404 0.922 . . . . 3.94 115.404 -163.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -136.38 -132.15 0.14 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 118.148 0.974 . . . . 3.68 111.714 -145.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 146.07 27.27 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.773 1.397 . . . . 5.55 114.773 -159.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -82.6 111.9 19.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 123.294 1.521 . . . . 4.76 109.916 159.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 31.2 ttp -135.41 175.67 9.37 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 125.887 1.675 . . . . 2.47 111.708 -155.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -116.57 147.74 41.55 Favored 'General case' 0 N--CA 1.439 -0.982 0 C-N-CA 128.684 2.794 . . . . 2.33 113.677 159.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -123.51 146.05 48.39 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.359 1.464 . . . . 0.97 109.232 166.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 18.3 p -124.07 168.56 12.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.751 1.22 . . . . 1.7 113.386 -173.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -48.56 140.96 7.48 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.586 1.554 . . . . 2.77 113.891 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 80.4 -0.88 83.77 Favored Glycine 0 CA--C 1.539 1.592 0 O-C-N 121.115 -0.99 . . . . 1.43 115.386 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.462 ' HB2' HD12 ' A' ' 584' ' ' ILE . 22.8 m -77.37 168.01 20.73 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.475 1.138 . . . . 1.11 111.204 164.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 20.3 p90 -133.52 166.65 22.07 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.082 1.141 . . . . 3.52 114.082 174.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -116.25 170.17 8.73 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.34 1.856 . . . . 2.29 113.644 -173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . -75.88 -131.81 0.37 Allowed Glycine 0 CA--C 1.534 1.255 0 C-N-CA 126.273 1.892 . . . . 3.73 116.204 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 67.47 -33.03 0.21 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 128.519 2.728 . . . . 9.87 115.776 -175.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 48.9 mt -14.28 114.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 130.409 3.484 . . . . 6.7 114.746 170.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 18.8 p -93.52 155.15 17.49 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.084 -0.71 . . . . 6.84 109.084 127.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.1 mt 178.07 -59.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 128.538 2.735 . . . . 2.35 108.291 164.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.23 17.34 15.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.965 2.506 . . . . 4.65 112.54 173.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.5 t -146.74 161.46 40.58 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 126.613 1.965 . . . . 2.74 111.004 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -154.44 139.25 17.12 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.311 1.844 . . . . 7.49 110.408 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 149.43 152.5 5.76 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 125.508 1.528 . . . . 2.04 112.857 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -57.64 134.66 56.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.388 1.475 . . . . 3.56 113.047 -175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 77.5 ttt-85 -121.6 156.19 33.46 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 126.237 1.815 . . . . 8.13 113.711 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 2.1 t -148.75 150.18 32.67 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.258 1.023 . . . . 3.19 112.914 158.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -162.48 153.77 17.84 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.463 1.505 . . . . 2.04 112.172 171.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 37.6 m -115.68 108.89 16.96 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.926 1.29 . . . . 1.98 112.81 177.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 1.3 p -153.3 139.35 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.016 1.326 . . . . 1.35 111.634 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -134.81 157.31 47.09 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.43 1.27 . . . . 4.12 114.43 -171.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -61.77 115.55 4.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.999 0.92 . . . . 0.95 110.64 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -70.84 -21.5 62.43 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 123.128 1.442 . . . . 2.22 112.094 175.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.6 t -169.92 166.71 9.36 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 129.202 3.001 . . . . 1.38 107.357 -157.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -59.96 116.5 4.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.007 0.923 . . . . 2.49 110.107 174.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.7 t -135.71 128.84 31.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.417 1.487 . . . . 2.32 110.451 -167.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -102.43 124.25 47.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 125.271 1.428 . . . . 3.13 110.814 -178.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 22.9 mt -115.45 165.65 12.75 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.451 1.9 . . . . 0.74 111.201 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -134.62 150.3 50.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.073 1.349 . . . . 8.08 110.363 178.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.2 t -139.41 143.98 37.89 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.09 1.145 . . . . 2.61 114.09 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.6 tt -123.85 121.03 34.31 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.209 1.804 . . . . 1.5 110.678 -175.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 27.9 p -85.54 136.0 33.59 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.23 1.412 . . . . 2.98 113.562 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.2 m -75.86 -20.74 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 113.801 1.037 . . . . 2.58 113.801 -171.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.71 -37.59 79.29 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.748 1.158 . . . . 4.04 110.754 171.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -79.51 -21.32 45.44 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.453 1.279 . . . . 4.48 114.453 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -69.48 -45.31 69.28 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.924 2.09 . . . . 2.54 111.333 167.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -68.05 -30.11 69.25 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.693 1.197 . . . . 2.74 111.805 176.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.39 -39.09 93.17 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.447 1.499 . . . . 4.21 113.972 173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.7 p -85.78 -32.2 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.249 1.02 . . . . 1.39 110.983 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 642' ' ' LEU . 6.7 mt -55.34 -32.03 62.2 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 114.722 1.378 . . . . 1.93 114.722 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -13.2 62.22 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.266 1.21 . . . . 6.31 114.266 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -87.37 -16.92 33.6 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.772 1.629 . . . . 3.5 114.134 173.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -129.57 70.2 81.77 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 127.248 2.219 . . . . 2.59 111.996 -172.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.8 -23.19 49.03 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.103 3.202 . . . . 1.6 115.443 -178.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 45.9 ttp -61.61 -48.33 81.41 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.585 1.554 . . . . 2.14 111.999 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -69.75 -34.15 73.43 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.431 -0.793 . . . . 1.6 111.294 -178.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -53.12 -58.49 6.83 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.748 1.219 . . . . 3.99 111.342 170.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 -36.37 83.42 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.192 0.812 . . . . 5.47 113.192 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -59.0 -25.77 63.93 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.104 1.15 . . . . 1.62 114.104 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -92.66 -44.72 8.42 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.437 1.095 . . . . 2.43 113.767 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -70.84 -7.75 47.67 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.487 1.291 . . . . 3.45 114.487 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.9 t -80.54 -59.65 2.61 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.113 1.365 . . . . 3.6 111.527 166.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.01 -33.48 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 124.509 1.124 . . . . 2.89 111.754 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -54.42 -20.59 7.78 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.892 1.277 . . . . 3.48 114.426 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.0 tt -122.15 -34.83 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 125.024 1.329 . . . . 5.9 113.168 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -69.82 -27.46 64.89 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.052 1.341 . . . . 5.81 113.723 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -72.51 -8.89 57.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.807 -1.183 . . . . 5.68 113.85 173.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 18.9 mt -97.63 -56.53 2.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.854 1.661 . . . . 5.28 110.668 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -139.6 127.94 22.72 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 126.101 1.76 . . . . 7.35 109.614 166.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 42.0 ptt85 -75.61 1.09 15.33 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 116.066 1.876 . . . . 12.75 116.066 -170.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -130.68 141.29 46.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.801 2.441 . . . . 13.01 111.279 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -84.26 -42.83 7.3 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.329 1.443 . . . . 17.15 115.846 -171.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt 51.11 64.22 1.93 Allowed 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.498 1.519 . . . . 18.57 114.046 170.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -43.23 159.34 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.169 3.388 . . . . 25.56 116.648 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -83.29 -34.42 25.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.671 1.588 . . . . 25.46 112.163 176.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 10.0 p -151.7 -60.36 0.17 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.11 1.364 . . . . 28.42 112.908 171.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.6 pt -146.65 167.41 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 126.485 1.914 . . . . 32.26 110.245 -174.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.6 mt -88.24 159.39 18.15 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.62 0.724 . . . . 30.39 112.303 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 41.0 tp -81.33 122.32 27.32 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.907 0.883 . . . . 32.76 110.75 170.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.256 1.427 0 C-N-CA 127.823 2.449 . . . . 37.7 114.341 165.417 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 121.718 0.77 . . . . 7.82 112.586 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 64.0 m -75.74 15.35 0.51 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.366 1.987 . . . . 3.73 116.366 -164.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 46.9 tpt85 -48.03 -47.78 33.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.185 1.394 . . . . 4.85 113.143 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.45 -30.24 27.41 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.499 1.666 . . . . 4.43 115.499 174.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 40.3 tp -79.94 -34.16 39.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.919 0.888 . . . . 2.4 112.51 -168.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.81 -52.97 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.382 0.673 . . . . 1.75 109.964 171.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -70.04 -18.02 63.28 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.764 1.394 . . . . 2.25 114.764 -167.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 13.9 t -79.71 -15.64 57.15 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.131 0.973 . . . . 3.65 112.198 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -69.75 146.66 95.86 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 121.264 -0.898 . . . . 3.27 111.702 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.23 -12.79 21.07 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 121.928 1.752 . . . . 3.55 112.983 -172.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.4 tt -59.6 -23.76 63.24 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 120.738 -1.226 . . . . 3.0 112.66 165.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -111.67 13.57 21.19 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.655 1.582 . . . . 2.53 113.17 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.96 -36.38 3.36 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 116.068 1.877 . . . . 2.02 116.068 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -127.28 21.74 6.65 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.782 1.633 . . . . 3.21 112.98 179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -61.8 156.41 20.58 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 112.7 0.63 . . . . 1.25 112.7 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.59 125.78 88.18 Favored Pre-proline 0 CA--C 1.548 0.896 0 O-C-N 121.654 -0.654 . . . . 2.02 109.244 163.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -63.5 -11.24 25.05 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 123.878 3.052 . . . . 1.06 114.258 -173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -93.26 -36.05 12.78 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.422 1.489 . . . . 1.8 111.093 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -60.42 -51.82 67.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.315 1.446 . . . . 1.92 110.86 171.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 7.8 m -59.27 -32.07 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 CA-C-O 121.864 0.84 . . . . 1.44 112.307 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 85.8 m -84.01 -38.61 20.7 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.232 1.813 . . . . 0.81 114.126 -177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -67.32 -18.64 65.25 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 121.509 -0.744 . . . . 0.71 112.203 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 20.2 ttm -71.81 -15.29 62.14 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.28 2.232 . . . . 0.75 114.113 174.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 32.8 mt -91.91 -16.02 27.24 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.869 1.062 . . . . 0.85 113.869 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.1 p -57.17 -32.12 66.1 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 114.529 1.307 . . . . 1.63 114.529 -168.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -106.95 9.26 30.77 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 115.039 1.496 . . . . 2.81 115.039 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.436 HD13 ' HG ' ' A' ' 633' ' ' LEU . 18.8 tp -64.89 151.19 46.27 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.004 1.322 . . . . 1.98 113.401 -166.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -126.4 146.48 50.05 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.24 1.416 . . . . 2.36 114.166 -171.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -109.14 156.72 19.51 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.586 1.154 . . . . 2.18 112.864 173.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -137.19 163.29 31.22 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.106 1.362 . . . . 3.89 112.589 179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' A' ' 629' ' ' ARG . 36.3 t -133.54 146.81 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 126.044 1.737 . . . . 1.01 111.985 175.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.417 ' CG ' HG22 ' A' ' 571' ' ' ILE . 87.9 m-85 -133.89 146.32 50.45 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.618 1.167 . . . . 2.14 111.777 168.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -95.58 161.07 28.95 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 125.171 1.388 . . . . 2.68 111.861 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -61.35 121.31 9.43 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.164 2.576 . . . . 1.27 113.735 -171.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 111.48 -19.07 24.59 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.805 1.669 . . . . 1.53 113.649 175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -78.16 138.96 38.97 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 124.061 0.945 . . . . 2.92 112.273 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -65.73 135.54 55.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.786 -0.643 . . . . 3.68 110.498 164.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.417 HG22 ' CG ' ' A' ' 565' ' ' PHE . 4.9 pt -100.56 -29.35 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 123.595 0.758 . . . . 1.17 112.869 -175.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 96.0 mt -138.62 117.01 13.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 127.661 2.385 . . . . 2.52 107.287 -174.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -153.03 143.53 22.63 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.956 1.702 . . . . 8.29 111.976 170.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -93.02 170.43 9.66 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.637 1.347 . . . . 5.85 114.637 -159.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . 168.04 -3.84 0.04 OUTLIER Glycine 0 CA--C 1.54 1.648 0 N-CA-C 116.753 1.461 . . . . 4.24 116.753 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.9 t -148.86 163.58 37.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 121.128 2.464 . . . . 2.96 113.587 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.2 mp -83.16 123.04 38.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.968 0.907 . . . . 3.07 109.406 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 86.95 110.56 0.88 Allowed Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.091 -1.203 . . . . 2.27 110.091 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -130.21 158.26 40.21 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.521 1.128 . . . . 4.34 111.537 -174.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 582' ' ' TYR . 62.8 pttt -85.11 172.7 11.03 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.559 1.543 . . . . 4.93 113.519 -178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -100.63 147.16 26.28 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.005 1.322 . . . . 2.39 111.51 175.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . 0.417 ' CE2' ' HE3' ' A' ' 580' ' ' LYS . 29.2 m-85 -137.2 145.28 43.48 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.155 1.382 . . . . 2.75 111.78 -174.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -150.16 159.62 44.29 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.857 1.058 . . . . 2.82 113.857 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.497 HD12 ' HB2' ' A' ' 605' ' ' SER . 11.8 mt -95.59 116.6 37.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.789 0.836 . . . . 1.0 111.77 -165.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.26 -52.36 5.44 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.961 1.304 . . . . 3.3 110.859 -176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -156.57 112.47 2.97 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.811 1.244 . . . . 3.58 111.408 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 149.3 -164.14 29.29 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.932 1.253 . . . . 0.99 111.616 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 42.2 t -136.54 146.51 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.927 1.291 . . . . 0.93 110.129 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -137.08 150.01 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.307 1.443 . . . . 0.72 111.756 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 58.2 m -101.83 121.89 42.95 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.763 0.825 . . . . 1.61 112.762 162.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 13.4 t -77.95 143.54 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 127.294 2.237 . . . . 3.29 109.214 165.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -115.6 131.25 56.99 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.453 1.101 . . . . 1.8 110.811 168.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 1.1 p -113.2 136.2 52.99 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.244 0.929 . . . . 2.96 113.008 172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 137.26 58.11 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.419 1.088 . . . . 5.58 111.645 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 86.25 -26.25 6.41 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 124.826 1.203 . . . . 4.95 114.514 -166.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.496 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 20.0 m-20 -130.4 -154.24 0.62 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 117.15 0.475 . . . . 4.77 111.513 -145.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -103.07 178.22 4.62 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.666 1.586 . . . . 4.29 113.845 -168.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -84.24 149.37 26.16 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.889 -1.05 . . . . 4.4 112.108 160.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 55.5 mtm -143.52 139.15 29.65 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.099 1.76 . . . . 2.35 111.358 -175.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.19 141.23 29.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.283 1.586 . . . . 2.15 115.283 -172.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 2.1 mp -133.55 158.17 43.84 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.677 2.791 . . . . 1.07 109.83 172.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 47.0 p -145.16 -178.83 6.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.511 1.124 . . . . 1.6 112.925 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.7 138.24 14.66 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.273 -0.892 . . . . 2.11 113.293 178.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 77.26 22.69 70.16 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.979 0.752 . . . . 2.29 114.979 -170.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.497 ' HB2' HD12 ' A' ' 584' ' ' ILE . 70.7 m -110.33 161.67 15.4 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.425 1.49 . . . . 1.17 111.325 167.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -136.55 136.44 39.3 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.685 1.194 . . . . 8.64 111.462 -166.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . 0.411 ' CZ ' HD11 ' A' ' 584' ' ' ILE . 56.7 m-85 -107.2 -179.78 4.03 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 115.476 1.658 . . . . 2.5 115.476 -173.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.87 178.14 46.31 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 126.059 1.79 . . . . 4.0 113.874 163.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -132.33 102.34 5.72 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.925 0.89 . . . . 6.12 110.493 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . 0.483 HG21 HG23 ' A' ' 614' ' ' THR . 67.7 mt 55.44 -82.75 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.692 1.997 . . . . 6.52 114.386 168.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 91.6 m 56.33 -43.23 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.457 3.103 . . . . 5.63 116.411 -165.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.761 HD23 HG22 ' A' ' 635' ' ' VAL . 37.3 mt -44.13 -41.94 5.98 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 126.668 1.987 . . . . 2.08 114.578 -169.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.79 14.32 4.0 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 115.486 1.661 . . . . 3.57 115.486 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 610' ' ' ILE . 44.2 p -99.06 160.22 14.42 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 125.117 1.367 . . . . 2.88 112.859 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 55.4 mtp180 -116.05 138.02 51.6 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.578 1.951 . . . . 7.64 112.249 -170.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 79.67 171.87 42.61 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 116.419 1.328 . . . . 2.68 116.419 176.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -58.16 142.15 48.21 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 126.44 1.896 . . . . 4.03 114.028 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -83.32 173.8 11.26 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.257 1.423 . . . . 6.81 111.986 166.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 13.3 t -146.08 124.99 12.7 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.949 0.9 . . . . 3.6 112.607 158.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -144.46 173.22 11.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.042 1.737 . . . . 1.87 111.425 175.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 21.8 m -154.21 113.08 3.66 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 120.563 -1.336 . . . . 2.17 111.516 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.4 p -150.37 142.17 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.768 0.827 . . . . 1.32 111.732 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -137.42 158.55 44.16 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.632 1.573 . . . . 3.37 114.134 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.48 131.96 40.47 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.013 1.325 . . . . 1.06 111.985 -178.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -23.54 28.1 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.047 0.927 . . . . 2.73 112.059 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 14.9 t -159.77 166.54 30.2 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.316 2.246 . . . . 1.27 109.444 -167.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.05 106.59 1.3 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.506 1.123 . . . . 3.2 108.94 177.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 22.2 t -119.56 134.54 55.18 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.676 1.591 . . . . 2.5 111.637 -165.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 564' ' ' VAL . 21.5 mmt180 -89.4 124.21 34.25 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.559 1.944 . . . . 5.12 108.382 169.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 45.5 mt -113.43 165.97 11.94 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.142 1.777 . . . . 0.98 111.202 171.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.57 140.17 53.2 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.175 1.39 . . . . 7.71 109.474 169.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 69.5 m -132.55 122.74 25.27 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.446 0.641 . . . . 2.57 111.528 -169.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 560' ' ' LEU . 2.9 tt -120.4 110.78 16.93 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.539 1.536 . . . . 1.45 108.836 -171.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 5.2 p -60.04 120.14 9.12 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.492 0.663 . . . . 2.77 111.116 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.761 HG22 HD23 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -51.91 -40.47 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 122.312 1.053 . . . . 2.58 111.984 -176.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -72.82 -26.9 61.67 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.622 -0.717 . . . . 2.66 110.59 -168.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -79.32 -17.68 54.09 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.105 1.762 . . . . 2.45 113.258 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -71.24 -46.83 60.22 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.478 1.911 . . . . 2.57 109.583 162.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -63.29 -26.58 68.84 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 120.856 -1.152 . . . . 2.17 112.986 175.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -70.07 -29.18 66.11 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.321 1.6 . . . . 3.11 115.321 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 6.9 p -93.88 -25.81 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.058 1.343 . . . . 0.9 112.701 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.1 mt -50.38 -40.95 51.12 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.391 0.676 . . . . 1.96 112.313 165.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -66.66 -18.78 65.55 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.956 1.095 . . . . 3.7 113.956 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -80.48 -18.7 47.84 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.072 1.306 . . . . 2.25 112.911 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -131.95 61.13 56.22 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.217 2.207 . . . . 1.95 108.878 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.49 -10.44 16.3 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.009 3.139 . . . . 2.14 116.038 -160.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -58.07 -33.01 68.59 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.628 1.558 . . . . 2.04 111.384 165.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -31.09 66.83 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.063 -1.023 . . . . 1.91 111.638 -171.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 -55.86 -60.59 3.25 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.19 0.905 . . . . 6.58 110.361 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 42.2 ptt85 -63.09 -32.48 73.86 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.712 0.634 . . . . 4.7 112.712 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -63.41 -29.5 70.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.736 . . . . 1.75 113.424 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -85.78 -34.32 21.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.057 0.943 . . . . 2.94 112.697 168.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -64.36 -28.29 69.6 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.211 -1.555 . . . . 4.51 113.515 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.1 t -77.28 -29.12 53.67 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.442 1.097 . . . . 2.79 113.361 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 5.1 p -88.27 -31.47 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.952 1.701 . . . . 2.91 112.133 177.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.04 63.7 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.586 0.958 . . . . 3.69 113.586 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 1.5 pp -75.34 -10.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 N-CA-C 114.161 1.171 . . . . 5.54 114.161 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -99.82 -34.15 10.27 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.946 1.699 . . . . 5.86 111.693 169.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -75.49 -2.6 29.65 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.814 1.246 . . . . 8.22 113.578 172.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.3 -24.11 65.72 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.661 1.984 . . . . 5.24 112.852 166.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -61.47 168.49 2.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.511 1.524 . . . . 8.01 114.504 -173.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 41.4 mtm180 -50.05 3.18 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 131.037 3.735 . . . . 11.99 118.407 -174.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 15.4 mm -53.43 111.87 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 126.297 1.839 . . . . 14.16 114.594 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 71.8 -9.47 4.95 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.672 1.606 . . . . 18.23 114.969 -174.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . 0.252 0.0 OUTLIER -114.71 21.39 14.48 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.467 1.907 . . . . 16.96 114.652 178.063 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 50.7 tttm -63.65 136.12 57.26 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.157 1.383 . . . . 22.23 111.01 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 20.2 m120 57.04 -10.54 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.018 2.527 . . . . 22.85 116.395 -173.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 14.7 m -76.45 134.17 39.64 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.114 1.766 . . . . 24.15 112.362 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 7.6 pt 49.83 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 129.034 2.934 . . . . 26.95 117.749 175.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 90.0 mt -117.4 165.33 13.62 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.342 1.857 . . . . 28.14 112.176 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.65 134.61 47.12 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.717 2.007 . . . . 28.56 112.167 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 59.9 t60 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 126.492 1.917 . . . . 34.14 113.186 163.562 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.055 0.761 . . . . 7.33 113.055 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 18.6 t -55.88 -25.68 43.66 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.94 -1.1 . . . . 4.03 113.543 -178.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.5 ptt-85 -56.55 -32.84 65.54 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.415 1.086 . . . . 5.81 113.304 170.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -81.7 -41.77 20.85 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.028 1.331 . . . . 4.56 111.474 171.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -56.56 18.99 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.525 1.13 . . . . 2.7 110.173 -172.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . 0.408 HG22 ' CZ ' ' A' ' 545' ' ' PHE . 0.5 OUTLIER -61.9 -34.88 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 O-C-N 121.623 -0.673 . . . . 1.0 111.405 176.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.04 -6.36 45.0 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.636 1.347 . . . . 1.4 114.636 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 73.6 m -85.51 -1.45 57.09 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.645 1.178 . . . . 2.72 112.532 -176.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 3.6 mmm -88.71 149.65 44.37 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 127.022 2.129 . . . . 3.42 112.207 177.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -66.39 -20.05 55.09 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.305 3.336 . . . . 2.01 112.058 173.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 mt -63.76 -24.16 67.65 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.462 1.105 . . . . 3.5 112.332 170.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . 0.408 ' CZ ' HG22 ' A' ' 539' ' ' VAL . 89.8 m-85 -121.09 22.74 10.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.867 2.067 . . . . 2.27 112.061 -178.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -59.97 -29.8 68.68 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.828 1.251 . . . . 1.8 112.575 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -123.09 7.17 9.19 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.899 2.08 . . . . 3.08 110.945 -165.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.48 147.68 52.24 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.848 1.659 . . . . 1.28 115.194 -175.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -82.6 140.14 44.32 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 125.306 1.442 . . . . 2.29 111.641 170.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.86 -19.44 52.62 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.27 2.647 . . . . 1.8 114.78 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -83.58 -40.28 19.28 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 120.345 1.429 . . . . 3.39 111.4 172.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -57.02 -51.44 69.25 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.483 1.113 . . . . 2.16 111.164 176.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.3 p -67.69 -28.05 40.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 123.967 0.907 . . . . 2.85 112.657 -176.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 94.4 m -84.22 -40.38 18.17 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.799 1.64 . . . . 1.15 112.806 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.23 -26.0 66.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.567 0.699 . . . . 0.86 111.874 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.2 ttm -71.32 -21.16 62.1 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.235 1.414 . . . . 0.77 113.528 178.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 23.5 mt -91.24 -22.57 20.53 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.848 1.055 . . . . 0.77 113.848 -168.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 49.6 p -70.35 -14.03 62.4 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 119.641 1.11 . . . . 2.22 113.697 -168.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.86 16.33 11.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 127.528 2.331 . . . . 2.99 113.397 176.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 13.1 tp -74.06 163.8 27.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.012 1.325 . . . . 2.43 112.343 -173.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -131.56 147.34 52.52 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.491 1.116 . . . . 1.83 113.078 -175.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -126.64 158.34 36.6 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.966 1.306 . . . . 2.35 113.586 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -145.76 158.09 43.88 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.109 0.964 . . . . 4.25 112.691 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.48 144.9 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 126.653 1.981 . . . . 0.96 112.073 175.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -131.5 160.49 35.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.59 -1.186 . . . . 2.35 111.278 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.5 mp0 -108.76 164.98 13.51 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 127.237 2.215 . . . . 2.48 110.655 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -61.36 120.92 8.84 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.202 1.935 . . . . 1.08 112.555 -172.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 107.62 -9.72 38.09 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 125.65 1.595 . . . . 1.09 114.353 178.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -88.85 135.47 33.51 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.549 1.675 . . . . 2.1 112.067 -174.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -68.61 112.14 5.2 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.063 0.945 . . . . 2.64 112.106 176.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.24 -14.7 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 C-N-CA 124.926 1.29 . . . . 1.13 113.735 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . 0.426 ' CG1' HG13 ' A' ' 622' ' ' VAL . 25.6 mm -97.14 142.11 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 125.083 1.353 . . . . 2.54 111.8 -168.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -117.26 176.57 5.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 128.391 2.676 . . . . 10.62 110.112 161.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.61 149.03 14.68 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.91 -1.119 . . . . 5.72 111.617 171.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -99.7 -22.16 12.94 Favored Glycine 0 N--CA 1.469 0.861 0 O-C-N 121.258 -0.901 . . . . 8.68 114.462 -159.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 68.2 p -126.4 -64.8 1.01 Allowed 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 113.473 0.916 . . . . 7.3 113.473 -158.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.71 107.19 6.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 121.93 0.871 . . . . 4.32 111.416 -164.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 69.4 23.48 76.43 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 114.637 -1.165 . . . . 4.23 111.404 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -131.46 175.93 8.73 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.268 1.827 . . . . 5.88 113.858 -163.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -121.53 168.81 11.31 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.501 2.32 . . . . 4.28 112.919 -163.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 19.5 ptm -89.49 159.55 17.19 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 112.244 0.461 . . . . 1.82 112.244 166.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -130.42 145.51 51.83 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.714 1.206 . . . . 3.19 110.151 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -152.47 161.5 42.5 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.319 -0.863 . . . . 2.46 113.32 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.464 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.1 mt -101.07 116.48 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.314 1.046 . . . . 0.77 110.761 -165.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -87.77 -56.7 3.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.175 0.99 . . . . 3.18 110.294 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -143.18 127.58 17.81 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.902 0.881 . . . . 3.77 110.391 166.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 146.83 -176.27 25.8 Favored Glycine 0 CA--C 1.522 0.472 0 O-C-N 121.074 -1.017 . . . . 0.83 111.211 176.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . 0.406 ' H ' ' CG2' ' A' ' 626' ' ' THR . 50.9 t -136.22 149.85 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.635 1.174 . . . . 0.86 109.033 176.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.433 ' HA ' ' H ' ' A' ' 625' ' ' ASP . 34.1 m -129.26 148.61 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.143 1.777 . . . . 0.75 110.818 176.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 34.3 m -106.53 127.29 53.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 123.107 1.432 . . . . 1.24 108.345 167.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 2.8 p -145.45 153.31 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 CA-C-N 112.908 -1.951 . . . . 2.56 109.215 -142.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.11 139.76 49.63 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.851 -0.426 . . . . 2.34 109.851 161.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 8.8 p -99.91 125.2 45.86 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 119.235 -0.986 . . . . 3.07 109.915 141.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.21 -17.44 56.75 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.967 1.84 . . . . 5.33 115.967 -155.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -79.01 -17.2 77.47 Favored Glycine 0 N--CA 1.472 1.033 0 C-N-CA 125.235 1.398 . . . . 5.08 114.431 163.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -131.38 -116.39 0.23 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.18 0.592 . . . . 4.95 109.954 -141.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.22 141.04 39.15 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 115.017 1.488 . . . . 6.62 115.017 -174.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.06 120.07 15.2 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.882 1.325 . . . . 5.0 109.661 146.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 28.2 ttp -136.33 172.61 12.77 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.398 1.479 . . . . 2.77 111.228 -158.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.77 143.02 41.94 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.495 2.718 . . . . 1.95 113.295 149.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.1 mp -119.51 148.22 43.53 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.32 1.448 . . . . 1.13 109.675 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 89.0 p -134.02 178.79 6.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.224 1.009 . . . . 1.54 113.605 -173.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -42.72 129.17 4.21 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.208 1.403 . . . . 2.1 112.936 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 84.3 19.89 59.8 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 116.34 1.296 . . . . 1.22 116.34 -172.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 584' ' ' ILE . 15.6 m -112.5 165.8 11.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.594 1.558 . . . . 1.06 114.129 177.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -135.2 139.27 44.39 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.395 1.078 . . . . 6.75 113.848 -166.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -101.83 165.69 11.06 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 115.887 1.81 . . . . 2.31 115.887 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 96.67 -12.07 66.24 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 126.082 1.801 . . . . 3.33 117.038 152.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 52.82 44.81 29.84 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.427 1.613 . . . . 7.1 113.772 -176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 54.4 mt -94.63 128.79 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.405 1.482 . . . . 7.59 111.737 -169.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 44.1 t -93.08 141.23 28.64 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.659 1.184 . . . . 6.26 110.594 159.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 38.4 mt -61.05 -19.97 62.02 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 120.797 -1.19 . . . . 2.24 114.054 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.1 pp -110.27 9.86 23.69 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.881 1.672 . . . . 5.18 115.022 174.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 6.6 t -49.86 148.29 3.25 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.851 1.261 . . . . 4.56 113.535 -178.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -133.96 147.57 51.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.953 1.301 . . . . 6.98 111.911 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 66.34 170.31 3.64 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-O 123.032 1.351 . . . . 3.1 113.596 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -65.07 126.81 29.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.761 1.625 . . . . 6.87 112.327 -178.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 20.3 ttt85 -129.77 154.47 47.18 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.614 0.765 . . . . 5.75 112.577 161.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 45.7 p -144.34 166.41 25.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.932 1.693 . . . . 4.65 113.187 -164.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -138.42 165.96 25.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.495 1.518 . . . . 1.94 113.536 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 23.3 m -131.66 87.18 2.42 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.244 1.818 . . . . 2.19 111.261 -174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . 0.426 HG13 ' CG1' ' A' ' 572' ' ' ILE . 1.1 p -157.82 143.55 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 N-CA-C 115.625 1.713 . . . . 0.91 115.625 -178.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.47 159.75 29.8 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 125.222 1.409 . . . . 4.95 114.365 173.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -65.52 128.37 35.63 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.509 1.123 . . . . 0.74 112.392 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . 0.433 ' H ' ' HA ' ' A' ' 589' ' ' VAL . 0.9 OUTLIER -79.22 -28.3 42.51 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.779 -0.575 . . . . 2.27 111.293 171.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . 0.406 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -151.95 177.87 10.01 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.058 0.943 . . . . 0.86 110.186 -167.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.46 100.77 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.119 0.872 . . . . 2.97 108.917 167.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.8 p -112.0 118.47 35.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.095 1.358 . . . . 2.24 110.002 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 113.04 19.72 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 127.356 2.262 . . . . 4.01 108.431 167.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 19.1 mt -115.23 167.69 10.61 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 125.193 1.397 . . . . 0.82 111.698 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -136.14 153.23 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.685 1.594 . . . . 7.37 110.736 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 23.3 t -138.94 144.26 38.96 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.321 0.86 . . . . 2.45 113.321 176.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 2.1 tt -138.94 132.72 30.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.145 1.778 . . . . 1.54 108.583 -175.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.23 137.75 35.83 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.5 1.12 . . . . 2.2 112.163 178.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 2.4 m -68.65 -32.54 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 O-C-N 121.674 -0.642 . . . . 1.88 110.878 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 46.0 m-20 -66.23 -41.04 90.61 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.048 0.84 . . . . 3.55 110.571 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -64.82 -39.11 93.06 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.622 1.169 . . . . 2.4 111.893 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.43 -52.03 66.95 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.209 1.803 . . . . 2.88 110.441 173.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -60.4 -30.85 69.86 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.032 1.333 . . . . 2.11 112.193 176.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -79.36 -25.07 42.28 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.313 1.845 . . . . 3.59 114.478 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 11.7 p -88.59 -25.98 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.879 0.872 . . . . 1.09 112.37 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 20.9 mt -58.44 -41.81 85.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.647 0.98 . . . . 2.31 113.647 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -65.32 -6.98 11.35 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 115.587 1.699 . . . . 4.54 115.587 173.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -78.85 -24.13 44.55 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 119.7 -1.875 . . . . 2.63 112.326 165.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -131.92 64.61 73.08 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 126.806 2.042 . . . . 2.15 109.362 -174.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.07 -20.28 36.79 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.047 3.165 . . . . 2.15 116.288 -164.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 15.7 ptt? -65.8 -35.4 80.59 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 121.21 1.823 . . . . 1.97 110.841 171.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 85.6 mmm -70.62 -32.73 70.16 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.36 1.064 . . . . 1.88 110.436 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -59.31 -48.99 79.56 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.612 -0.68 . . . . 5.08 109.548 170.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -60.36 -39.1 85.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.141 0.793 . . . . 7.97 113.141 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -58.34 -23.14 55.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.99 1.716 . . . . 2.25 113.503 177.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -91.94 -40.88 10.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.987 1.315 . . . . 3.21 113.079 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -57.78 -21.44 41.72 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.381 1.252 . . . . 4.12 114.381 175.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 11.7 t -87.86 -31.27 19.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.876 1.27 . . . . 3.46 113.375 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.66 -34.47 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 124.328 1.051 . . . . 3.45 110.851 177.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -59.16 -22.34 60.8 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.812 1.412 . . . . 3.87 114.812 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 17.6 tt -95.25 -20.85 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.9 1.28 . . . . 4.77 113.376 173.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -95.05 -31.85 13.4 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.772 -1.205 . . . . 5.36 113.59 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -73.22 -1.07 16.25 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.214 2.206 . . . . 5.75 112.625 168.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.5 tp -102.21 -65.98 0.95 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.967 2.507 . . . . 5.17 112.597 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -102.23 159.8 15.09 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.707 1.203 . . . . 6.75 112.227 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.82 -43.65 9.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.064 0.946 . . . . 12.11 111.613 168.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 26.9 mm 61.46 -45.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 128.795 2.838 . . . . 11.64 114.23 -170.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 170.86 -90.61 0.09 OUTLIER Glycine 0 CA--C 1.528 0.894 0 C-N-CA 129.655 3.502 . . . . 14.46 106.762 178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt 59.07 156.53 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 129.844 3.258 . . . . 17.2 116.179 173.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -157.74 144.48 17.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.196 2.198 . . . . 24.16 109.764 175.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -156.34 146.15 21.06 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.217 0.821 . . . . 24.4 113.217 -172.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 83.7 p -68.13 177.44 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.07 1.348 . . . . 27.75 114.264 176.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.5 159.43 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.849 1.66 . . . . 33.71 113.45 -170.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 61.0 tp -100.86 108.02 19.7 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.58 1.552 . . . . 32.9 109.522 175.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.77 168.13 14.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.781 1.232 . . . . 36.86 112.872 -171.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.57 1.948 . . . . 42.38 112.665 -177.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 CA--C 1.544 0.743 0 CA-C-O 120.794 0.33 . . . . 8.53 111.672 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 22.6 p -75.64 35.86 0.13 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.471 2.026 . . . . 3.3 116.471 -160.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -54.96 -39.12 68.59 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.758 1.223 . . . . 4.67 112.684 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.791 1.237 . . . . 4.57 112.689 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -78.13 -47.22 18.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.243 1.017 . . . . 2.48 111.396 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.12 -36.47 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.176 0.59 . . . . 1.88 112.142 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.26 -16.7 64.43 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.913 -1.117 . . . . 2.13 113.704 173.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.43 -5.74 57.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.242 -0.912 . . . . 3.6 112.764 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.6 139.99 41.13 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 127.439 2.296 . . . . 2.98 111.111 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.99 -23.67 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.847 3.031 . . . . 2.88 115.135 -172.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.2 tt -73.92 -19.01 60.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.895 1.678 . . . . 2.74 113.453 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.34 9.28 19.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.246 2.218 . . . . 2.45 112.822 -176.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -55.11 -29.46 57.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.68 1.592 . . . . 2.14 114.065 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -118.94 13.88 13.16 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 129.201 3.0 . . . . 2.84 110.193 -170.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -73.03 145.84 46.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.233 1.013 . . . . 1.14 112.937 176.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -69.41 135.8 88.68 Favored Pre-proline 0 CA--C 1.552 1.028 0 O-C-N 121.482 -0.761 . . . . 2.38 110.928 167.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.55 -17.75 33.75 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.519 2.813 . . . . 1.21 114.374 -173.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -86.21 -39.17 16.89 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.311 1.044 . . . . 1.94 110.216 173.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -60.93 -52.27 65.73 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.464 1.506 . . . . 2.09 111.734 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.0 -29.4 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 124.03 0.932 . . . . 2.83 112.385 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 81.5 m -81.79 -35.7 29.24 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.066 1.746 . . . . 1.06 112.772 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -69.47 -18.93 63.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.092 0.557 . . . . 0.77 111.702 -178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 16.5 ttm -72.91 -24.35 60.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.532 1.133 . . . . 0.95 113.632 178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.4 -22.01 44.88 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.826 0.85 . . . . 1.09 113.104 -167.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 73.6 p -68.23 -26.8 65.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.639 1.576 . . . . 1.92 114.712 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.96 22.89 10.91 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.692 2.397 . . . . 4.89 113.671 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 561' ' ' LYS . 5.0 tt -84.79 149.45 25.73 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.565 1.946 . . . . 2.28 110.056 -173.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . 0.512 ' N ' HD23 ' A' ' 560' ' ' LEU . 1.3 tpmt? -120.7 138.99 53.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.53 1.132 . . . . 2.13 111.937 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -128.92 158.04 39.91 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.153 1.381 . . . . 3.4 111.769 -176.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -147.78 152.42 37.67 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.065 0.546 . . . . 2.89 112.409 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 58.8 t -117.14 146.96 20.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 124.607 1.163 . . . . 1.24 111.128 178.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . 0.413 ' CG ' HG22 ' A' ' 571' ' ' ILE . 90.2 m-85 -125.21 144.93 50.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.246 1.419 . . . . 2.06 111.666 168.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -95.39 167.73 12.26 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 125.729 1.611 . . . . 2.65 111.156 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -56.63 128.14 28.79 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.386 2.057 . . . . 1.24 114.013 -174.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 91.76 -9.06 77.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.72 1.628 . . . . 1.23 112.943 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -79.45 124.45 28.47 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.169 1.485 . . . . 2.52 111.439 -168.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -67.6 120.36 13.88 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.463 1.105 . . . . 2.78 110.79 177.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.413 HG22 ' CG ' ' A' ' 565' ' ' PHE . 13.1 pt -93.99 -29.68 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 N-CA-C 115.409 1.633 . . . . 0.93 115.409 -160.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 18.4 mt -123.93 148.63 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.879 1.672 . . . . 1.48 112.066 -166.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 8.3 tpp180 -151.1 154.5 37.08 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.834 1.42 . . . . 7.41 114.834 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 57.8 tt0 -88.48 141.79 28.24 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.822 1.649 . . . . 6.34 112.076 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -176.18 -12.55 0.02 OUTLIER Glycine 0 CA--C 1.536 1.374 0 N-CA-C 118.349 2.099 . . . . 4.56 118.349 177.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 7.0 t -157.9 163.18 38.16 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 120.418 2.109 . . . . 2.86 114.434 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -94.26 138.54 20.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 127.637 2.375 . . . . 2.58 108.795 168.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 81.51 36.27 20.53 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 111.254 -0.738 . . . . 1.74 111.254 -176.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.9 153.13 25.64 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.136 2.174 . . . . 4.72 111.634 -179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -84.31 155.51 22.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.119 1.368 . . . . 4.17 112.897 176.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -96.21 138.62 33.55 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.77 0.656 . . . . 1.95 112.77 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -118.4 143.11 46.9 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.824 1.25 . . . . 2.49 112.238 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -148.32 162.93 38.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.71 -1.244 . . . . 2.75 113.275 167.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 12.1 mt -90.69 110.11 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 123.759 0.824 . . . . 1.48 110.203 -169.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -89.2 -45.03 9.86 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.175 0.59 . . . . 3.1 111.578 -174.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -156.45 105.63 2.28 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.034 0.834 . . . . 2.75 112.946 171.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 155.31 -158.06 28.14 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.815 1.198 . . . . 1.23 111.677 169.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 26.3 t -136.9 146.31 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 125.296 1.439 . . . . 0.99 109.368 -177.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 32.7 m -129.51 151.73 36.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 125.866 1.666 . . . . 0.72 110.237 177.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 50.1 m -119.11 124.63 47.34 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 125.942 1.697 . . . . 1.25 107.79 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . 0.508 HG12 ' O ' ' A' ' 599' ' ' MET . 7.5 p -139.34 150.18 22.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 107.812 -1.181 . . . . 2.59 107.812 -141.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -132.39 126.02 32.18 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 120.958 0.408 . . . . 1.78 110.495 -178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 10.3 p -81.33 142.28 33.22 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.605 0.965 . . . . 2.6 113.605 163.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.93 136.27 41.4 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 119.907 -1.745 . . . . 5.37 112.108 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.75 -19.6 6.07 Favored Glycine 0 N--CA 1.471 0.968 0 C-N-CA 123.357 0.503 . . . . 4.49 114.165 -161.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.548 ' HA ' ' HE3' ' A' ' 597' ' ' LYS . 40.7 m-20 -129.36 -142.55 0.25 Allowed 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.959 -0.73 . . . . 4.28 110.977 -144.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.548 ' HE3' ' HA ' ' A' ' 596' ' ' ASN . 0.0 OUTLIER -100.37 161.98 13.24 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 114.194 1.183 . . . . 4.66 114.194 -156.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -80.21 133.54 36.03 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.597 1.189 . . . . 3.69 111.626 158.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . 0.508 ' O ' HG12 ' A' ' 591' ' ' VAL . 4.9 mpp? -114.83 175.73 5.36 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 126.412 1.885 . . . . 2.84 110.33 162.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -109.51 154.05 23.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.084 1.753 . . . . 2.43 111.64 141.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 1.8 mp -124.78 160.33 28.92 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.732 2.013 . . . . 1.19 109.836 166.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 59.8 p -147.88 -179.86 7.21 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 120.901 -1.124 . . . . 1.51 113.672 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.89 138.17 15.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.714 1.005 . . . . 3.19 113.714 -174.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 91.48 -13.02 67.64 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.738 1.161 . . . . 1.8 115.519 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . . . . . . . . . 68.6 m -85.61 163.97 18.01 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.772 1.286 . . . . 1.64 111.943 171.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -144.46 153.73 42.2 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.625 1.342 . . . . 4.01 114.625 -176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -163.89 -179.18 6.12 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 115.076 1.51 . . . . 2.19 115.076 -167.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 82.71 1.67 90.57 Favored Glycine 0 CA--C 1.535 1.296 0 N-CA-C 116.438 1.335 . . . . 4.12 116.438 167.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -160.59 -178.22 6.73 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.505 1.522 . . . . 7.79 110.176 -177.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 77.8 mt -119.15 -63.77 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.703 1.201 . . . . 6.14 111.219 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 24.9 t -157.83 152.17 24.68 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.723 1.379 . . . . 6.31 114.723 -172.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.795 HD23 HG22 ' A' ' 635' ' ' VAL . 2.5 mt -59.41 -5.49 0.8 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 127.624 2.369 . . . . 1.95 114.574 167.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.3 mp -125.61 -4.84 7.09 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.299 1.839 . . . . 4.06 113.866 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.2 t -124.79 143.23 50.91 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 114.068 1.136 . . . . 3.17 114.068 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -134.7 137.85 43.9 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.269 1.427 . . . . 6.57 111.807 -171.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 175.84 167.09 34.28 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 124.639 1.114 . . . . 2.58 113.08 177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -60.55 114.42 2.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.845 1.258 . . . . 5.1 110.096 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -95.86 126.45 41.13 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.68 0.792 . . . . 5.62 110.967 -177.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 7.2 m -120.07 126.68 51.35 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.493 1.117 . . . . 3.33 110.291 -176.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -150.7 177.43 10.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.08 1.752 . . . . 2.05 111.921 -174.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 35.4 t -151.52 96.24 2.24 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.96 1.304 . . . . 2.77 110.958 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -154.1 144.74 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 120.725 -1.234 . . . . 1.01 113.629 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -132.64 162.66 30.76 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.189 1.795 . . . . 4.58 112.371 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -75.36 138.59 41.85 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 120.848 -1.157 . . . . 0.92 112.779 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -76.02 -19.97 58.2 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.736 1.255 . . . . 3.29 112.413 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 8.8 t -169.33 -179.57 3.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.716 2.006 . . . . 1.14 109.172 -156.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -65.13 127.05 30.07 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.742 -1.224 . . . . 4.0 109.125 163.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 16.9 t -139.17 126.39 21.35 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.375 1.07 . . . . 2.81 111.125 -173.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -89.17 131.62 35.22 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.138 0.975 . . . . 3.67 111.055 169.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 51.4 mt -117.61 157.76 25.83 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 125.291 1.436 . . . . 1.35 110.389 175.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -96.93 145.72 25.63 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.392 -1.336 . . . . 8.05 107.392 156.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 79.9 p -152.74 102.99 2.74 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 122.095 0.95 . . . . 2.52 110.513 169.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.91 139.99 53.33 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.064 0.946 . . . . 3.07 110.01 -165.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.9 t -52.13 126.72 19.51 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.994 0.918 . . . . 2.44 109.341 176.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . 0.795 HG22 HD23 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -60.08 -38.96 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-O 121.899 0.857 . . . . 2.8 109.584 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.09 -29.77 68.78 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 120.26 -0.576 . . . . 3.57 110.436 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -65.69 -18.19 65.15 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.133 1.373 . . . . 2.58 114.176 175.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.448 ' HB3' HD21 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -84.78 -44.53 13.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.012 2.525 . . . . 2.64 109.447 168.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -59.33 -23.04 62.15 Favored 'General case' 0 CA--C 1.556 1.188 0 O-C-N 120.902 -1.124 . . . . 2.46 113.026 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.43 -31.92 60.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 127.212 2.205 . . . . 3.83 114.675 175.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 2.4 p -90.58 -25.09 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.925 1.29 . . . . 0.93 111.941 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.42 -34.57 61.63 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.036 1.124 . . . . 2.29 114.036 167.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.48 -27.44 48.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.148 1.379 . . . . 2.97 114.147 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -81.3 -18.1 47.0 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.851 1.26 . . . . 2.14 114.044 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -136.15 66.75 60.98 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 125.809 1.644 . . . . 2.25 110.092 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.54 -23.14 24.07 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 124.227 3.285 . . . . 1.36 116.493 -167.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -61.75 -28.63 69.57 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.196 1.362 . . . . 2.31 112.982 172.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 61.8 mmm -80.47 -34.61 35.73 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.038 1.335 . . . . 1.66 111.738 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -55.12 38.65 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.218 0.917 . . . . 4.16 110.292 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -62.41 -37.1 84.48 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.532 0.567 . . . . 6.97 112.532 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -57.39 -23.06 46.88 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.411 1.263 . . . . 1.79 114.411 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -91.53 -44.58 9.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.51 1.524 . . . . 2.34 114.051 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.82 -18.46 61.46 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.553 -1.342 . . . . 3.53 113.849 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 8.0 t -78.24 -42.57 30.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.607 1.163 . . . . 2.63 112.133 175.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.86 -33.81 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.682 1.593 . . . . 3.61 111.945 -175.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -61.22 -10.29 6.45 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.59 1.33 . . . . 3.92 114.59 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 8.1 tp -115.04 -33.34 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.365 1.466 . . . . 5.39 112.978 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.57 -31.1 71.97 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 120.507 -1.37 . . . . 6.41 113.532 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -90.26 -15.76 30.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 127.629 2.371 . . . . 8.3 113.201 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 10.0 tt -80.87 -41.11 23.66 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.372 1.469 . . . . 7.05 112.637 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -150.26 145.64 26.32 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.228 -0.92 . . . . 9.19 111.911 170.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -84.4 -20.05 32.51 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.128 1.371 . . . . 15.46 114.109 -179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 24.3 mm 63.15 -33.45 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 128.737 2.815 . . . . 14.98 117.258 172.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 102.6 28.49 6.3 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 125.882 1.706 . . . . 19.71 112.806 -156.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -136.4 166.81 22.61 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.151 1.78 . . . . 19.94 111.899 -178.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -154.23 101.88 2.42 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.48 1.112 . . . . 26.46 111.93 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -83.26 -24.41 32.3 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.534 2.334 . . . . 25.92 112.769 178.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 5.6 m -62.86 166.85 5.17 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.457 1.103 . . . . 27.88 113.89 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 14.6 pt -69.78 151.73 9.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 125.23 1.412 . . . . 32.3 114.402 -166.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -110.06 9.3 24.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.912 1.685 . . . . 35.38 113.669 171.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -81.44 113.0 19.21 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.131 1.372 . . . . 38.07 109.144 176.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 127.089 2.155 . . . . 42.67 114.421 -179.597 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 113.473 0.916 . . . . 7.89 113.473 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 96.2 m -76.05 -15.0 60.2 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.458 1.651 . . . . 4.68 115.458 -167.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -60.56 -48.46 81.67 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.334 0.97 . . . . 4.83 111.914 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -57.42 -24.61 56.58 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.988 1.315 . . . . 3.75 113.626 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -91.87 -41.61 10.52 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.252 0.621 . . . . 2.13 110.405 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -39.04 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.743 -0.598 . . . . 1.38 110.527 167.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -72.42 -2.95 21.34 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.961 1.304 . . . . 2.19 114.491 174.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 29.3 m -98.05 -10.66 23.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.101 0.961 . . . . 2.51 113.166 175.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.0 129.44 56.2 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 125.97 1.708 . . . . 2.63 111.338 -165.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -64.54 -17.25 58.98 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.931 2.421 . . . . 1.68 114.915 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.1 tt -74.96 -22.08 58.79 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.93 1.292 . . . . 2.8 112.892 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -105.98 16.72 24.69 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 128.262 2.625 . . . . 2.26 111.37 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -57.22 -40.32 77.29 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.657 1.583 . . . . 1.67 112.475 -170.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -111.27 13.64 21.7 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 128.378 2.671 . . . . 3.07 111.179 -168.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -76.45 139.84 41.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.192 1.397 . . . . 1.41 114.22 -172.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -68.49 133.55 90.95 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 123.352 0.661 . . . . 2.4 110.666 171.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -59.65 -14.17 25.11 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 124.036 3.157 . . . . 1.57 115.513 -172.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -90.88 -35.27 14.86 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.186 0.995 . . . . 2.66 112.404 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -62.76 -46.76 86.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.374 1.07 . . . . 1.96 110.54 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 4.2 m -66.28 -30.0 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 N-CA-C 113.837 1.051 . . . . 1.43 113.837 -179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 72.8 m -82.65 -39.34 22.24 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.078 2.151 . . . . 1.04 111.664 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -60.82 -18.11 53.6 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.917 1.08 . . . . 0.8 113.917 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . 0.553 ' HG3' HG11 ' A' ' 641' ' ' VAL . 29.9 mtm -76.6 -23.31 53.44 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.512 1.301 . . . . 1.56 114.512 171.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 37.6 mt -84.27 -16.49 42.94 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 121.122 -0.986 . . . . 0.86 113.448 -166.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 81.6 p -70.83 -9.23 57.13 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 114.403 1.26 . . . . 2.02 114.403 -172.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -120.78 14.53 11.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.883 2.073 . . . . 2.55 113.521 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 633' ' ' LEU . 23.8 tp -83.77 153.9 23.87 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.941 1.297 . . . . 2.21 112.311 -157.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.58 150.04 50.37 Favored 'General case' 0 CA--C 1.516 -0.348 0 C-N-CA 125.043 1.337 . . . . 3.4 113.144 177.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -135.69 161.77 34.63 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.694 1.198 . . . . 3.05 111.485 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -142.0 152.49 43.46 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 126.739 2.016 . . . . 2.76 110.123 -177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.438 HG11 ' CE1' ' A' ' 627' ' ' TYR . 15.7 t -118.81 142.22 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-O 121.936 0.874 . . . . 1.16 111.776 178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -115.01 134.75 54.92 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.463 1.105 . . . . 1.92 110.604 170.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -83.55 164.22 46.07 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.509 1.123 . . . . 2.99 110.732 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -60.96 121.69 10.06 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.205 1.937 . . . . 1.53 112.122 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 98.99 9.78 51.11 Favored Glycine 0 CA--C 1.526 0.722 0 C-N-CA 124.727 1.156 . . . . 1.84 114.075 172.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -97.8 142.76 29.16 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.954 1.377 . . . . 1.85 112.138 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -77.01 121.2 23.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.946 0.898 . . . . 4.02 109.086 172.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.9 pt -92.02 -21.74 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 114.489 1.292 . . . . 1.16 114.489 -163.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 46.8 mt -136.84 128.29 42.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 C-N-CA 126.198 1.799 . . . . 1.73 110.141 -170.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -146.16 94.46 2.47 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.621 1.168 . . . . 7.15 109.705 165.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -85.56 156.99 20.52 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.78 1.232 . . . . 5.62 111.796 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -168.37 -19.62 0.02 OUTLIER Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.874 1.702 . . . . 3.59 115.009 -170.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.5 t -105.22 154.16 20.59 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.081 1.941 . . . . 2.94 113.328 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 2.1 mp -83.73 114.97 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.819 1.248 . . . . 3.21 109.74 -174.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 77.59 50.5 6.53 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.366 0.984 . . . . 2.05 113.372 171.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -69.28 177.79 2.65 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 123.542 0.737 . . . . 4.93 112.154 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 21.4 mmtm -87.24 159.36 18.84 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.824 2.05 . . . . 6.63 110.423 175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 8.0 ptm -87.56 150.51 23.66 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.763 1.394 . . . . 2.31 114.763 -168.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.8 141.97 51.25 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.784 1.634 . . . . 5.46 112.338 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -154.75 169.85 22.98 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.941 1.089 . . . . 2.68 113.941 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.583 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.7 mt -101.28 109.15 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.862 0.865 . . . . 1.2 111.458 -170.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -81.84 -42.51 19.52 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.672 0.99 . . . . 2.66 113.672 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -157.39 122.52 4.51 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.505 1.048 . . . . 2.54 112.295 169.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 148.74 -156.79 27.02 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 123.847 0.737 . . . . 1.14 112.082 168.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 38.8 t -138.4 143.45 32.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 124.557 1.143 . . . . 1.02 110.194 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 24.7 m -134.97 147.62 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 124.445 1.098 . . . . 0.86 112.284 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 3.5 m -103.45 113.78 27.54 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.504 1.121 . . . . 1.08 111.737 171.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 5.1 t -86.04 142.48 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.703 2.001 . . . . 3.02 109.797 173.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -110.24 138.99 45.88 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.875 1.27 . . . . 2.46 108.934 161.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -113.69 135.37 54.01 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.91 0.777 . . . . 3.23 112.009 173.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.37 136.54 56.6 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.536 0.734 . . . . 4.87 111.592 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 79.85 -18.21 7.91 Favored Glycine 0 N--CA 1.47 0.961 0 C-N-CA 124.844 1.211 . . . . 4.99 115.856 -168.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 32.8 m-20 -137.26 -147.07 0.23 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.17 0.985 . . . . 4.66 112.776 -144.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 162.99 12.5 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 126.457 1.903 . . . . 3.34 114.596 -162.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.04 134.47 33.84 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.858 -1.519 . . . . 3.28 111.973 163.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 52.2 mtm -141.25 133.13 27.49 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.645 1.578 . . . . 2.03 113.144 -169.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -91.2 126.99 36.46 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.223 1.194 . . . . 2.26 114.223 177.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.2 mp -120.27 158.85 26.17 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.895 2.078 . . . . 1.26 110.248 172.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 35.2 t -147.11 -177.94 5.94 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.994 1.317 . . . . 2.52 111.81 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -58.0 144.88 38.1 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.84 1.422 . . . . 2.59 114.84 -166.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 85.37 -17.08 35.75 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.531 1.062 . . . . 1.68 114.999 -164.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.583 ' HB2' HD12 ' A' ' 584' ' ' ILE . 16.9 m -69.63 156.47 38.9 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 118.994 1.397 . . . . 1.28 110.754 167.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -141.12 144.83 35.09 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.358 1.463 . . . . 3.81 111.47 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -152.16 171.27 18.18 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.135 1.532 . . . . 2.21 115.135 -165.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 71.83 126.26 0.07 OUTLIER Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.859 1.218 . . . . 2.76 110.494 -151.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -73.8 27.04 0.07 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 114.567 1.321 . . . . 6.07 114.567 -171.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 60.5 mt -73.19 110.83 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.846 1.658 . . . . 8.44 110.152 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 49.9 t -85.32 148.7 25.91 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.254 1.422 . . . . 6.14 111.821 173.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.7 mt -67.57 1.14 2.54 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.68 1.363 . . . . 2.21 114.68 175.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 2.0 pp -130.96 17.01 5.13 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.673 1.589 . . . . 4.44 115.19 164.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 1.7 t -56.36 165.82 0.99 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 116.812 2.153 . . . . 4.42 116.812 -171.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 74.8 mtp85 -132.33 146.62 52.11 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.269 1.828 . . . . 7.12 111.436 168.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 80.27 -177.76 54.18 Favored Glycine 0 CA--C 1.538 1.497 0 N-CA-C 116.138 1.215 . . . . 2.48 116.138 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -88.95 173.55 8.42 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 125.177 1.391 . . . . 4.45 111.537 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -131.97 173.96 10.66 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.367 1.867 . . . . 7.05 111.488 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 12.6 t -144.82 149.79 36.03 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.801 0.841 . . . . 3.99 110.691 163.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -151.07 166.67 30.05 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.281 1.833 . . . . 1.9 111.447 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 4.9 p -133.21 93.25 3.14 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.567 1.947 . . . . 2.76 110.777 -177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 3.8 p -150.09 140.34 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.191 0.812 . . . . 1.11 113.191 -175.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -136.45 161.96 34.39 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.012 1.725 . . . . 5.12 113.782 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -83.87 124.92 31.47 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.562 1.145 . . . . 1.17 113.144 -173.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -71.0 -26.77 63.27 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.33 -0.856 . . . . 3.07 111.783 174.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 10.3 t -163.62 172.41 14.34 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.536 2.734 . . . . 1.29 110.115 -158.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.438 ' CE1' HG11 ' A' ' 564' ' ' VAL . 3.7 t80 -63.99 109.21 1.72 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.951 1.25 . . . . 2.66 108.577 170.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.6 t -124.08 124.93 43.61 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.887 1.275 . . . . 2.75 111.189 -167.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -87.56 118.23 26.9 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.165 1.786 . . . . 4.26 110.229 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 32.3 mt -114.61 151.01 34.19 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 125.487 1.515 . . . . 1.33 110.668 177.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -100.03 166.04 11.23 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.426 -0.796 . . . . 7.55 111.678 175.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 17.5 m -137.28 115.5 11.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.481 -1.387 . . . . 1.79 112.23 159.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.492 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.6 OUTLIER -119.53 130.87 55.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.245 1.418 . . . . 1.36 111.062 -177.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 46.7 t -79.3 130.92 35.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.725 1.38 . . . . 2.28 114.725 -176.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 6.7 m -65.97 -28.49 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 118.741 -0.647 . . . . 1.9 112.434 168.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -58.68 -42.1 87.72 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.108 0.867 . . . . 2.64 109.11 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . 0.686 ' O ' HG12 ' A' ' 641' ' ' VAL . 27.4 m120 -71.19 -36.99 72.13 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 117.994 -1.003 . . . . 2.18 112.775 174.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -55.99 -47.09 78.35 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.493 1.497 . . . . 2.78 111.449 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -72.05 -20.54 61.66 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.156 1.382 . . . . 2.05 112.94 178.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.73 -60.46 2.27 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.149 1.779 . . . . 3.5 112.321 172.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 637' ' ' ASN . 7.7 p -67.81 -27.79 39.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 126.871 2.068 . . . . 1.23 112.633 -172.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 5.8 mt -46.86 -39.09 11.4 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.611 1.337 . . . . 2.24 114.611 173.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.14 -17.94 65.07 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.539 1.681 . . . . 4.59 115.539 -179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.97 -21.14 59.34 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.901 0.88 . . . . 3.0 112.75 174.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -125.19 68.72 58.22 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 126.801 2.04 . . . . 2.07 110.401 -172.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.98 -28.07 47.95 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.602 3.534 . . . . 2.43 116.269 -168.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 41.4 ttp -61.14 -42.23 98.18 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.685 1.129 . . . . 2.26 112.207 172.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 18.7 mmt -72.97 -36.69 67.15 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.278 0.631 . . . . 2.26 110.737 175.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -56.55 -48.34 77.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.381 0.991 . . . . 6.49 111.657 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -64.81 -35.02 79.75 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 114.225 1.194 . . . . 6.69 114.225 174.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -61.01 -25.03 66.6 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.41 1.084 . . . . 1.65 113.601 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -91.05 -14.99 30.29 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.096 1.359 . . . . 2.61 113.86 170.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -84.23 -19.71 33.48 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.735 1.214 . . . . 3.75 113.253 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 1.8 t -77.93 -44.88 25.61 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.749 1.22 . . . . 2.7 112.696 174.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 2.5 p -59.34 -36.37 63.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.249 1.019 . . . . 3.05 111.02 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -62.69 -1.73 0.93 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.934 1.828 . . . . 4.62 115.934 173.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 18.1 tt -127.78 -28.05 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.155 1.382 . . . . 5.42 113.006 166.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -65.57 -38.05 88.43 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.94 -1.725 . . . . 4.03 112.751 172.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -82.36 -15.57 52.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.614 1.966 . . . . 5.31 113.413 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -93.23 -7.56 44.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.46 1.504 . . . . 7.4 112.698 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 29.8 t0 61.36 173.09 0.11 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.783 2.033 . . . . 9.72 114.189 -172.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -51.9 -60.81 2.75 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.341 1.856 . . . . 14.15 112.793 -175.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 33.6 mm 58.02 147.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.768 2.427 . . . . 16.16 113.464 -175.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -72.23 96.12 0.7 Allowed Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.731 -1.231 . . . . 20.03 110.615 173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -91.81 151.96 20.34 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 117.886 0.843 . . . . 22.31 112.774 -176.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -82.98 163.91 20.73 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.898 1.279 . . . . 27.73 112.126 165.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -62.18 -47.82 82.77 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.559 0.948 . . . . 28.9 113.559 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 69.0 m 54.44 -161.04 0.15 Allowed 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.945 1.298 . . . . 30.31 114.337 178.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 38.6 pt -69.98 157.63 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.189 2.195 . . . . 31.93 114.356 -170.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.62 178.07 8.39 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.995 0.918 . . . . 35.17 113.046 174.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -142.77 125.0 15.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.08 0.952 . . . . 34.04 110.641 166.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . . . . . . . . . 36.2 t60 . . . . . 0 C--O 1.255 1.355 0 C-N-CA 128.021 2.529 . . . . 40.04 114.658 176.042 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 33.0 m120 . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 113.866 1.061 . . . . 8.88 113.866 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 8.2 t -53.68 -41.87 67.34 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.352 -0.842 . . . . 3.39 113.084 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 37.7 ttm105 -79.44 -26.09 41.87 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.318 1.047 . . . . 4.4 112.874 175.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.98 -34.89 64.4 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.505 0.928 . . . . 3.96 113.505 177.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 49.5 mt -80.26 -42.92 22.27 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.399 0.68 . . . . 3.18 112.074 -174.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.27 -37.44 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 118.492 0.587 . . . . 1.21 110.825 170.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -73.98 -4.71 36.89 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.007 1.484 . . . . 1.47 115.007 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 8.8 t -82.7 -17.04 45.83 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.615 0.766 . . . . 3.12 110.989 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 79.0 mtp -64.91 136.5 96.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 124.652 1.181 . . . . 2.09 111.05 169.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -65.19 -26.12 57.32 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.86 2.374 . . . . 2.26 111.606 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 10.5 tt -61.98 -23.28 66.3 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.847 2.059 . . . . 2.67 113.195 170.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -108.98 6.49 25.23 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.653 1.981 . . . . 2.16 113.524 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -60.19 -29.16 68.52 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.332 -1.48 . . . . 1.8 113.545 -171.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -123.13 8.81 9.21 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.807 2.443 . . . . 3.31 110.726 -167.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -64.05 152.97 38.85 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.891 1.676 . . . . 1.1 113.423 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -71.36 127.85 90.8 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 122.931 0.492 . . . . 2.31 110.482 167.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -63.38 -10.59 22.01 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.388 3.392 . . . . 1.04 114.987 -174.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -91.52 -42.44 10.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.091 1.356 . . . . 1.84 110.497 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.15 -47.84 82.1 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.859 1.263 . . . . 1.86 111.417 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 8.3 m -63.32 -30.11 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 121.913 0.863 . . . . 1.37 113.023 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 51.5 m -82.6 -33.91 27.81 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.429 2.292 . . . . 0.93 112.39 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -64.72 -19.29 65.68 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.378 0.671 . . . . 1.02 112.156 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.25 -37.45 87.26 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.153 0.797 . . . . 1.42 113.153 171.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.93 -16.69 61.09 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.695 0.998 . . . . 1.32 113.695 -156.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 9.6 t -87.96 -18.03 29.98 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.067 1.136 . . . . 3.51 114.067 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . . . . . . . . 0.429 0.0 OUTLIER -126.08 23.96 7.02 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.944 1.297 . . . . 5.04 114.387 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.69 173.22 7.99 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.501 1.12 . . . . 2.63 113.151 162.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.68 151.35 31.95 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.519 1.128 . . . . 1.99 112.708 169.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.64 145.07 44.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.381 1.072 . . . . 2.55 111.189 158.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -150.25 159.36 44.49 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.064 1.346 . . . . 3.17 111.0 -176.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . . . . . . . . . 45.5 t -112.33 149.44 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.021 0.929 . . . . 0.94 111.514 178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -118.75 145.23 45.73 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.503 0.721 . . . . 2.04 110.373 162.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -81.04 161.3 63.54 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.39 1.076 . . . . 3.38 112.015 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -60.33 122.16 10.9 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 122.468 2.112 . . . . 1.32 111.795 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 103.52 -2.61 46.16 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 125.496 1.522 . . . . 1.48 114.593 175.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -86.95 136.99 32.74 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.086 1.443 . . . . 2.17 110.205 174.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -73.52 121.88 21.3 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.602 -0.686 . . . . 2.66 109.198 172.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 5.1 pt -78.57 -24.85 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.229 0.611 . . . . 1.21 112.446 -174.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 75.5 mt -142.28 132.22 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 126.478 1.911 . . . . 2.04 110.14 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 28.1 mmt180 -141.3 170.22 16.14 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.762 2.425 . . . . 8.59 109.788 166.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.57 153.88 34.38 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.29 1.036 . . . . 6.06 112.403 168.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -179.48 -19.45 0.03 OUTLIER Glycine 0 CA--C 1.534 1.276 0 N-CA-C 116.38 1.312 . . . . 4.26 116.38 174.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 14.2 t -158.98 165.45 34.05 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.826 1.813 . . . . 3.23 112.285 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.31 130.94 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 124.971 1.308 . . . . 2.18 109.849 166.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 83.75 54.69 3.01 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.867 -0.893 . . . . 2.48 110.867 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -67.46 139.43 57.05 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.943 -0.74 . . . . 3.99 110.708 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -84.09 168.42 15.88 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.515 0.931 . . . . 3.63 113.515 -164.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 18.2 tpt -88.22 134.82 33.69 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.799 1.24 . . . . 1.99 109.666 -175.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -128.51 142.46 51.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.453 1.501 . . . . 2.6 109.943 175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.94 155.17 42.07 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 121.002 -1.062 . . . . 3.6 111.44 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.52 HD12 ' HB2' ' A' ' 605' ' ' SER . 16.0 mt -96.28 101.29 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.057 -0.519 . . . . 1.19 110.287 -161.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -73.96 -46.62 42.85 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.743 0.817 . . . . 2.99 111.716 -177.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 18.7 t-80 -151.42 126.44 9.79 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.079 0.951 . . . . 2.66 111.245 164.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 153.26 178.17 27.55 Favored Glycine 0 CA--C 1.524 0.632 0 O-C-N 120.497 -1.377 . . . . 0.92 111.858 178.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . 0.437 ' H ' ' CG2' ' A' ' 626' ' ' THR . 97.6 t -127.47 147.94 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 C-N-CA 125.16 1.384 . . . . 0.99 108.117 171.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.32 148.1 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.862 1.265 . . . . 0.71 111.438 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 73.0 m -101.03 121.0 41.02 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.307 0.575 . . . . 1.1 112.386 162.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 11.9 t -94.27 140.64 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 127.371 2.268 . . . . 2.9 110.333 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -111.95 149.3 32.13 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.846 1.259 . . . . 1.63 108.72 160.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 164.26 14.86 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.389 1.076 . . . . 2.51 111.441 -172.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.86 81.46 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 126.038 1.735 . . . . 6.39 114.881 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . 93.01 14.67 54.41 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 125.264 1.411 . . . . 3.8 115.105 -169.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.16 163.44 32.73 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 116.872 2.175 . . . . 3.69 116.872 -171.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . 0.421 ' H ' ' CD ' ' A' ' 597' ' ' LYS . 0.0 OUTLIER -105.4 174.18 5.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 129.963 3.305 . . . . 6.34 116.306 -168.685 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.3 145.7 45.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 116.502 2.038 . . . . 4.56 116.502 -137.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 73.2 mtm -123.61 129.34 51.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.525 1.53 . . . . 1.73 111.774 172.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.96 118.43 26.33 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.004 1.321 . . . . 2.36 111.511 174.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 10.3 mp -118.11 153.94 32.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.781 1.632 . . . . 1.66 110.904 178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 29.0 p -118.97 172.52 7.48 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.13 1.772 . . . . 1.54 113.228 -169.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.64 137.31 44.1 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.002 -1.061 . . . . 2.66 112.529 170.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 92.64 -9.37 75.86 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.054 1.311 . . . . 1.42 115.798 -167.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.52 ' HB2' HD12 ' A' ' 584' ' ' ILE . 75.3 m -78.14 160.02 28.27 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.525 1.13 . . . . 1.18 111.852 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 29.0 p90 -150.54 146.8 26.81 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 115.21 1.559 . . . . 4.06 115.21 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -157.59 179.04 9.6 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.789 1.403 . . . . 2.76 114.789 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 164.96 -140.78 6.62 Favored Glycine 0 CA--C 1.538 1.501 0 C-N-CA 124.837 1.208 . . . . 2.66 113.278 -168.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . 0.44 ' HG2' ' H ' ' A' ' 610' ' ' ILE . 5.0 tt0 -77.53 -163.6 0.41 Allowed 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 118.127 0.963 . . . . 7.95 112.026 173.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . 0.44 ' H ' ' HG2' ' A' ' 609' ' ' GLU . 48.0 mt -63.88 -44.82 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.526 1.53 . . . . 7.18 111.513 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 22.4 t -156.26 159.39 38.83 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.275 1.43 . . . . 7.38 110.482 165.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -22.13 25.27 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 120.347 -1.471 . . . . 3.75 112.129 170.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 4.6 mp -78.49 -24.59 45.8 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 125.681 1.593 . . . . 3.74 115.029 174.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 52.0 p -88.58 161.46 16.91 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.429 1.092 . . . . 3.12 113.022 -177.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -142.25 126.04 17.06 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.945 1.298 . . . . 10.03 110.551 165.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 173.67 158.54 18.18 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.814 1.197 . . . . 2.26 112.902 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -70.82 77.32 0.62 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.632 1.173 . . . . 3.84 113.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 12.4 tpt85 -65.34 127.09 30.33 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.586 1.554 . . . . 7.39 110.24 173.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 59.8 p -90.14 144.22 26.07 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.276 0.631 . . . . 3.43 110.768 171.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.17 164.23 37.75 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.399 1.08 . . . . 1.97 112.476 -169.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 54.0 m -156.82 88.92 1.06 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.757 -1.214 . . . . 1.85 110.218 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.6 p -137.6 135.43 46.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 121.121 -0.987 . . . . 0.95 111.103 175.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 1.8 ptt85 -127.44 151.51 48.73 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.855 1.428 . . . . 3.97 114.855 -172.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -68.75 120.53 14.86 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.75 1.22 . . . . 1.04 110.655 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -25.67 55.74 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.471 -0.768 . . . . 2.53 111.765 174.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . 0.437 ' CG2' ' H ' ' A' ' 588' ' ' VAL . 4.5 t -143.87 179.86 6.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.138 1.775 . . . . 1.48 109.306 -175.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.31 97.16 0.18 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 107.169 -1.419 . . . . 3.66 107.169 168.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 13.3 p -100.94 121.04 41.05 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.274 1.03 . . . . 2.37 110.513 -166.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -84.68 108.78 17.57 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.924 2.09 . . . . 3.25 109.096 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 16.8 mt -116.55 157.12 25.76 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.832 0.825 . . . . 0.8 111.058 -175.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 157.63 15.94 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.469 1.108 . . . . 7.03 109.319 165.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 68.0 p -146.05 129.92 17.23 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.337 0.866 . . . . 1.71 113.337 168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 1.4 tt -143.76 120.42 11.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.348 1.459 . . . . 1.43 110.1 -171.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 44.8 t -74.65 143.77 44.12 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.134 -0.979 . . . . 3.5 112.922 176.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 3.3 m -67.52 -18.64 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 120.551 -1.343 . . . . 2.66 112.957 174.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -61.79 -37.13 83.22 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.726 1.148 . . . . 3.12 110.591 169.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -79.57 -18.24 52.17 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.354 2.261 . . . . 3.25 113.863 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -73.11 -51.33 18.39 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 127.176 2.19 . . . . 2.53 112.008 161.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -68.3 -21.5 64.77 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.913 -1.117 . . . . 2.17 112.215 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -71.0 -43.15 68.59 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.269 2.228 . . . . 5.18 113.183 170.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 7.2 p -78.98 -29.02 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 1.12 112.663 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 14.8 mt -49.88 -40.36 42.51 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.958 0.725 . . . . 1.86 112.958 170.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.96 -18.02 62.69 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.722 1.379 . . . . 3.32 114.722 -175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.45 -15.14 55.99 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.953 1.301 . . . . 2.55 114.351 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -127.85 74.23 78.67 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 126.885 2.074 . . . . 2.41 110.228 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -52.65 -23.55 20.23 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 124.048 3.165 . . . . 1.87 117.654 -169.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -76.33 -34.87 58.98 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 122.033 2.197 . . . . 2.28 112.65 170.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.02 -39.1 66.27 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.164 0.985 . . . . 2.06 109.279 175.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.45 -54.42 22.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.58 1.152 . . . . 4.88 110.622 169.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? -55.43 -43.73 75.61 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.468 1.507 . . . . 5.07 112.557 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -56.84 -27.54 60.3 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.334 1.235 . . . . 2.42 114.334 -177.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -96.06 -30.2 13.69 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.553 1.686 . . . . 2.79 115.553 174.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -74.96 -28.16 60.46 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.573 1.533 . . . . 5.07 112.836 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 2.0 t -73.21 -15.09 61.45 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.616 1.567 . . . . 4.65 112.855 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.3 p -104.53 -36.42 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 127.201 2.2 . . . . 4.63 111.745 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.1 65.51 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.044 1.128 . . . . 4.92 114.044 175.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 16.1 tt -77.69 -17.98 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.081 1.352 . . . . 8.02 113.369 175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -119.53 -39.86 2.84 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.437 1.495 . . . . 7.32 113.563 -158.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 39.0 ptt85 -68.91 -26.32 65.04 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 115.729 1.751 . . . . 8.47 115.729 -170.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 63.1 tp -98.97 -41.02 7.77 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.832 0.853 . . . . 6.38 113.297 -158.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -66.03 159.06 26.74 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.36 0.874 . . . . 11.96 113.36 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -67.18 7.81 0.37 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 129.037 2.935 . . . . 14.44 117.883 -161.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . . 21.3 mm -80.77 143.2 12.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 125.873 1.669 . . . . 12.78 109.625 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -75.09 120.5 6.23 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.261 1.41 . . . . 14.41 111.725 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -93.48 128.37 39.55 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.978 0.911 . . . . 15.13 111.09 -169.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -71.07 -29.51 65.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 118.981 0.809 . . . . 22.79 112.749 176.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -67.02 127.76 33.8 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.406 1.482 . . . . 21.07 112.368 174.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 49.0 m -85.41 -169.22 2.54 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.202 1.401 . . . . 22.03 112.677 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 32.4 pt -65.76 152.66 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 O-C-N 120.68 -1.262 . . . . 26.11 113.033 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 55.4 tp -80.48 140.79 35.74 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.328 1.451 . . . . 26.87 111.524 -177.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.464 ' CD1' ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -145.44 -179.77 6.88 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.172 1.789 . . . . 31.51 111.165 -177.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.464 ' H ' ' CD1' ' A' ' 671' ' ' LEU . 8.1 t60 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 126.916 2.086 . . . . 37.64 111.678 173.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 CA--C 1.549 0.942 0 N-CA-C 116.466 2.024 . . . . 8.69 116.466 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.37 -33.65 71.45 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.432 -1.417 . . . . 3.63 113.866 -179.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -65.89 -48.57 71.05 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.825 0.85 . . . . 4.46 111.487 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -57.3 -33.93 68.18 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.278 1.031 . . . . 4.0 112.468 171.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 35.8 mt -76.2 -35.69 58.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.911 0.884 . . . . 2.43 112.549 -173.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -74.38 -39.88 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.996 0.816 . . . . 1.12 111.118 168.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -68.33 -9.62 49.18 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 115.216 1.561 . . . . 1.57 115.216 -178.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 45.5 m -101.32 -11.39 19.48 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.474 1.51 . . . . 2.77 113.66 -173.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.05 147.0 86.98 Favored Pre-proline 0 CA--C 1.542 0.647 0 C-N-CA 124.961 1.305 . . . . 2.59 111.068 175.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.79 -21.08 58.56 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.072 2.514 . . . . 1.59 112.661 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.26 -15.93 60.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.944 1.298 . . . . 3.49 112.733 172.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -113.36 6.8 17.42 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 127.324 2.25 . . . . 2.28 112.818 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' ALA . . . . . . . . . . . . . . . -44.26 -37.95 3.55 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.471 2.309 . . . . 1.7 115.746 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -122.56 16.83 10.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.491 1.516 . . . . 2.99 112.784 -179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -55.5 145.22 23.5 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.44 1.096 . . . . 1.35 113.942 -177.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -68.31 125.18 91.32 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 124.924 1.29 . . . . 2.16 110.718 169.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.0 -10.55 25.93 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 123.818 3.012 . . . . 1.22 115.373 -172.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -95.05 -33.23 12.77 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.379 1.472 . . . . 2.32 112.177 172.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.94 -47.56 85.84 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.41 1.084 . . . . 2.19 111.379 173.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' VAL . . . . . . . . . . . . . 11.4 m -63.34 -30.92 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.31 0.644 . . . . 1.57 112.378 -176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' THR . . . . . . . . . . . . . 71.9 m -79.81 -39.57 30.49 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.064 1.745 . . . . 1.08 112.352 176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.9 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.405 -0.809 . . . . 0.77 112.505 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' MET . . . . . . . . . . . . . 30.7 ttm -71.48 -21.72 61.9 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.743 1.217 . . . . 0.92 113.983 178.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' LEU . . . . . . . . . . . . . 12.4 mt -90.41 -8.3 50.95 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.759 1.224 . . . . 1.06 113.089 -171.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' THR . . . . . . . . . . . . . 7.1 t -60.79 -24.38 65.77 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.074 1.879 . . . . 3.02 116.074 -163.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' LYS . . . . . 0.423 ' O ' ' HE3' ' A' ' 559' ' ' LYS 0.278 0.0 OUTLIER -125.24 19.99 8.18 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 115.324 1.602 . . . . 2.43 115.324 170.09 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.421 HD13 ' HG ' ' A' ' 633' ' ' LEU . 29.5 tp -65.24 158.99 24.73 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.192 2.197 . . . . 2.3 113.371 -168.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' LYS . . . . . 0.412 ' H ' HD12 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -135.45 155.53 50.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.726 1.61 . . . . 2.24 112.19 -176.106 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -131.91 155.53 47.73 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.304 1.042 . . . . 2.51 112.968 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -139.44 145.55 38.98 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.409 1.883 . . . . 2.84 110.571 -175.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' VAL . . . . . 0.529 HG11 ' CE1' ' A' ' 627' ' ' TYR . 21.8 t -121.14 142.05 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 O-C-N 121.27 -0.894 . . . . 0.92 112.921 -174.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -120.7 143.85 48.52 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.884 1.274 . . . . 2.66 111.734 170.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -85.86 166.43 29.46 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.362 1.465 . . . . 2.39 111.991 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.75 129.55 32.76 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.087 2.525 . . . . 1.27 113.929 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' GLY . . . . . . . . . . . . . . . 100.93 -14.36 58.72 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 126.432 1.968 . . . . 1.75 113.61 173.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -82.86 131.46 35.19 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.269 1.034 . . . . 2.69 112.401 -164.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.79 115.09 7.74 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.973 0.909 . . . . 2.76 110.583 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 10.7 pt -82.95 -27.05 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 114.328 1.233 . . . . 1.17 114.328 -166.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' ILE . . . . . . . . . . . . . 31.1 mt -133.16 133.92 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 125.984 1.713 . . . . 1.89 111.24 -168.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -146.16 104.33 3.8 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.047 1.339 . . . . 7.47 109.918 166.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -71.11 146.99 48.88 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.756 1.222 . . . . 4.53 111.959 178.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' GLY . . . . . . . . . . . . . . . -160.07 -5.64 0.05 OUTLIER Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.221 -1.877 . . . . 4.15 115.537 178.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 11.2 t -157.79 160.37 37.73 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.518 2.659 . . . . 2.97 114.309 -176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.16 146.23 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 126.278 1.831 . . . . 2.47 111.937 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' GLY . . . . . . . . . . . . . . . 98.22 34.42 5.37 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.007 1.289 . . . . 1.75 114.75 165.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 579' ' ' LYS . 0.0 OUTLIER -61.87 124.71 21.5 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 118.834 1.317 . . . . 4.4 113.056 -167.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 62.3 pttt -87.69 177.03 7.15 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.757 1.223 . . . . 3.28 113.794 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' MET . . . . . . . . . . . . . 33.4 mmm -87.36 127.45 35.2 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.57 0.748 . . . . 2.23 111.683 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -123.88 138.87 54.42 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.957 1.303 . . . . 3.03 108.585 166.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -144.35 166.97 23.59 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.883 -1.136 . . . . 2.48 112.863 -177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.449 HD12 ' HB2' ' A' ' 605' ' ' SER . 12.0 mt -89.25 108.37 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 109.627 -0.509 . . . . 1.29 109.627 -172.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -90.14 -44.52 9.73 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.046 1.338 . . . . 4.64 111.583 -175.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -156.39 111.44 2.88 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 120.069 1.304 . . . . 3.2 112.695 164.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' GLY . . . . . . . . . . . . . . . 150.83 -160.57 28.67 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.746 1.165 . . . . 1.27 111.785 171.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' VAL . . . . . . . . . . . . . 41.0 t -135.63 146.36 29.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 125.009 1.324 . . . . 1.34 110.116 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 35.3 m -133.34 150.41 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.471 1.508 . . . . 1.09 111.469 179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' SER . . . . . . . . . . . . . 5.8 m -101.25 112.23 24.66 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.454 0.702 . . . . 1.39 110.677 162.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' VAL . . . . . . . . . . . . . 9.3 t -77.13 145.4 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.61 1.164 . . . . 3.03 108.258 167.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.64 140.0 44.0 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 108.212 -1.033 . . . . 2.37 108.212 163.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.24 131.84 54.69 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.111 0.869 . . . . 3.04 109.912 160.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 594' ' ' LYS . . . . . 0.532 ' H ' ' HD3' ' A' ' 594' ' ' LYS . 1.1 pmtp? -59.45 -27.05 65.74 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.87 1.804 . . . . 5.93 115.87 -161.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 595' ' ' GLY . . . . . . . . . . . . . . . -83.62 -11.45 79.79 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 124.371 0.986 . . . . 4.74 115.095 172.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -142.86 -146.44 0.19 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.727 0.811 . . . . 4.76 112.4 -141.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 597' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.77 171.19 7.47 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.031 2.133 . . . . 4.14 115.172 -167.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 598' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -68.56 136.62 53.36 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.034 0.934 . . . . 4.42 112.272 162.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 599' ' ' MET . . . . . . . . . . . . . 62.9 mtm -130.21 123.6 30.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.404 1.482 . . . . 2.28 112.592 176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -91.42 118.19 30.33 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.15 1.167 . . . . 2.38 114.15 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 601' ' ' LEU . . . . . . . . . . . . . 11.3 mp -123.3 159.3 29.09 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.551 1.94 . . . . 1.56 111.045 -178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 602' ' ' SER . . . . . . . . . . . . . 75.5 p -140.75 -176.85 4.81 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.606 1.562 . . . . 1.76 112.665 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 603' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -39.49 132.82 1.49 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.71 1.204 . . . . 2.37 113.519 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 604' ' ' GLY . . . . . . . . . . . . . . . 87.64 0.88 83.71 Favored Glycine 0 CA--C 1.533 1.193 0 N-CA-C 115.773 1.069 . . . . 1.65 115.773 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 605' ' ' SER . . . . . 0.449 ' HB2' HD12 ' A' ' 584' ' ' ILE . 57.8 m -89.11 158.73 17.84 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.741 1.217 . . . . 1.32 110.583 160.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 606' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -149.47 155.18 39.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.711 1.004 . . . . 3.82 113.711 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 607' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.59 -176.17 4.76 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 2.71 113.184 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 608' ' ' GLY . . . . . . . . . . . . . . . 88.77 -74.65 2.04 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.793 -1.192 . . . . 3.0 110.653 -165.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 609' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 41.62 90.64 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.674 2.79 . . . . 8.22 117.567 169.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 610' ' ' ILE . . . . . . . . . . . . . 2.6 mt -136.75 157.25 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.642 1.177 . . . . 7.47 108.981 161.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 611' ' ' CYS . . . . . . . . . . . . . 87.7 m -60.0 140.9 56.46 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.913 -1.117 . . . . 6.92 113.712 178.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' ' 638' ' ' PHE . 51.9 mt -63.09 -32.56 73.96 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.945 0.898 . . . . 3.05 112.898 -164.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 613' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.59 -14.52 60.79 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.394 1.257 . . . . 6.67 114.394 174.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 614' ' ' THR . . . . . . . . . . . . . 47.3 p -72.6 164.79 25.9 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 115.329 1.603 . . . . 4.32 115.329 -174.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 615' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -130.49 106.7 8.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.65 1.98 . . . . 8.2 109.528 154.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -163.5 165.98 37.02 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.449 1.024 . . . . 3.06 114.52 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -76.26 148.22 37.74 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.118 1.367 . . . . 4.09 112.504 164.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -137.71 123.29 19.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.005 0.922 . . . . 6.53 112.215 155.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 619' ' ' THR . . . . . . . . . . . . . 4.6 t -100.55 151.31 21.74 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.221 1.193 . . . . 2.98 114.221 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 620' ' ' ALA . . . . . . . . . . . . . . . -152.19 168.22 26.03 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 126.162 1.785 . . . . 1.47 112.726 177.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 621' ' ' SER . . . . . . . . . . . . . 12.1 m -131.6 106.45 8.18 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.395 1.478 . . . . 1.81 110.419 170.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 622' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.25 143.21 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 121.135 -0.978 . . . . 0.99 112.069 -176.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 623' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -135.04 160.22 39.02 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.662 1.585 . . . . 3.48 112.796 -179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 624' ' ' ALA . . . . . . . . . . . . . . . -82.46 136.7 34.85 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.506 -0.746 . . . . 1.14 112.74 -175.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 625' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -76.68 -24.96 53.2 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 122.545 1.164 . . . . 3.3 111.913 173.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 626' ' ' THR . . . . . . . . . . . . . 7.0 t -159.92 172.97 16.63 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.055 2.142 . . . . 1.34 109.193 -156.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 627' ' ' TYR . . . . . 0.529 ' CE1' HG11 ' A' ' 564' ' ' VAL . 4.8 t80 -67.99 100.9 1.03 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.365 -0.976 . . . . 3.25 108.365 172.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 10.9 t -113.56 127.7 56.17 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.907 1.283 . . . . 2.61 111.577 -167.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 629' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -86.16 120.02 27.08 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.052 1.341 . . . . 4.62 109.676 170.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 630' ' ' LEU . . . . . . . . . . . . . 46.4 mt -106.33 156.15 18.79 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 124.996 1.318 . . . . 1.16 109.93 170.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 631' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -98.95 164.44 12.19 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.184 0.594 . . . . 7.32 110.272 169.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 632' ' ' SER . . . . . . . . . . . . . 57.1 p -143.02 114.6 8.04 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.079 0.952 . . . . 2.34 112.15 173.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.421 ' HG ' HD13 ' A' ' 560' ' ' LEU . 0.3 OUTLIER -131.98 130.0 40.89 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.301 1.041 . . . . 2.56 112.02 -178.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 48.4 t -76.05 139.26 41.34 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.52 0.934 . . . . 2.64 113.52 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 635' ' ' VAL . . . . . . . . . . . . . 10.2 m -64.27 -23.62 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 O-C-N 121.155 -0.966 . . . . 1.77 112.16 172.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 636' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -70.35 -20.39 62.98 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.249 1.386 . . . . 3.17 112.865 174.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 637' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -85.52 -36.09 20.72 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.442 1.097 . . . . 2.16 111.434 166.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 638' ' ' PHE . . . . . 0.41 ' CE1' HD11 ' A' ' 612' ' ' LEU . 0.4 OUTLIER -61.81 -49.53 75.93 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.866 1.266 . . . . 2.93 111.438 175.474 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 639' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -64.99 -20.71 66.64 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.123 1.369 . . . . 1.88 112.982 174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 640' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -80.55 -45.22 17.76 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 127.357 2.263 . . . . 4.6 111.455 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 641' ' ' VAL . . . . . . . . . . . . . 8.8 p -69.74 -27.53 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.288 0.635 . . . . 1.05 111.88 171.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 642' ' ' LEU . . . . . . . . . . . . . 1.3 tp -50.86 -35.74 34.23 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.86 1.264 . . . . 2.58 114.247 166.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 643' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -81.45 -13.68 57.92 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.767 1.025 . . . . 3.09 113.767 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 644' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -81.75 -20.28 39.63 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.098 1.317 . . . . 2.95 112.301 174.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 645' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -139.55 63.05 26.06 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.202 2.201 . . . . 2.25 110.489 -177.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 646' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -58.53 -14.74 22.14 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 124.603 3.536 . . . . 1.65 116.714 -167.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 647' ' ' MET . . . . . . . . . . . . . 37.1 ttp -54.48 -44.28 72.48 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.529 1.059 . . . . 1.66 111.847 164.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 648' ' ' MET . . . . . . . . . . . . . 71.2 mmm -67.58 -26.3 66.21 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.279 -0.888 . . . . 1.97 112.252 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 649' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -61.07 -50.81 71.76 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.24 -0.912 . . . . 4.3 111.669 -177.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 650' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -60.0 -34.18 72.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.724 1.009 . . . . 5.44 113.724 177.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -66.77 -25.54 66.53 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.512 1.525 . . . . 2.16 113.546 176.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -90.74 -21.33 21.62 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.513 1.525 . . . . 2.76 113.998 170.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -81.78 -27.72 33.59 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 114.13 1.159 . . . . 4.12 114.13 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 654' ' ' THR . . . . . . . . . . . . . 13.4 t -76.66 -42.96 39.98 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.023 1.329 . . . . 3.49 111.713 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 655' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.51 -36.66 77.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.512 1.525 . . . . 3.42 111.706 173.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -69.07 7.18 0.76 Allowed 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 115.073 1.508 . . . . 3.2 115.073 177.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 657' ' ' ILE . . . . . . . . . . . . . 21.3 tt -127.84 -40.25 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.127 0.971 . . . . 5.09 112.6 158.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 658' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -58.87 -38.13 78.1 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 120.13 1.332 . . . . 4.58 112.629 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 659' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 -75.22 -5.57 45.2 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.186 1.794 . . . . 6.75 113.616 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -100.3 -9.01 22.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.453 1.501 . . . . 6.1 113.3 -175.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 661' ' ' ASP . . . . . . . . . . . . . 4.6 t70 57.53 -160.85 0.23 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.753 1.221 . . . . 7.75 112.268 -175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -64.66 -13.77 55.38 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 119.347 -2.096 . . . . 11.77 115.297 -173.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 663' ' ' ILE . . . . . . . . . . . . 0.261 2.6 pp -82.74 -10.86 12.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 114.107 1.151 . . . . 11.31 114.107 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . -71.91 94.68 0.61 Allowed Glycine 0 CA--C 1.533 1.185 0 N-CA-C 109.975 -1.25 . . . . 13.86 109.975 162.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -140.47 25.05 2.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.523 1.675 . . . . 16.3 115.523 -158.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 666' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -56.75 -36.66 70.03 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.846 1.259 . . . . 23.65 113.735 -176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 667' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -152.63 142.53 22.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.02 0.928 . . . . 22.01 112.288 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 3.1 t -83.43 -59.04 2.58 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.264 0.625 . . . . 22.45 112.592 173.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 669' ' ' ILE . . . . . . . . . . . . . 48.4 pt -140.69 162.02 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.206 1.403 . . . . 27.87 112.921 -167.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -150.2 165.54 32.59 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.886 1.069 . . . . 28.6 113.886 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.555 HD13 ' H ' ' A' ' 672' ' ' HIS . 0.2 OUTLIER -66.47 158.12 30.33 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.498 1.519 . . . . 33.86 113.271 -175.298 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 672' ' ' HIS . . . . . 0.555 ' H ' HD13 ' A' ' 671' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 128.757 2.823 . . . . 37.42 113.359 170.756 . . . . . . . . 2 2 . 1 stop_ save_